SCHEMBL6615523

SCHEMBL6615523

CC(C)(C)NCc1ccc(N)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 1/20 0.46
▸ TSHR P16473 2/20 0.44
▸ TDP1 Q9NUW8 2/20 0.44
▸ GFER P55789 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ CYP3A4 P08684 1/20 0.44
▸ LOXL2 Q9Y4K0 1/20 0.42
▸ HTT P42858 2/20 0.42
▸ CA2 P00918 2/20 0.41
▸ LTA4H P09960 1/20 0.41
▸ PPIB P23284 1/20 0.40
▸ PPIA P62937 1/20 0.40
▸ PPID Q08752 1/20 0.40
▸ PPIG Q13427 1/20 0.40
▸ ADRB2 P07550 1/20 0.39
▸ ADRB1 P08588 1/20 0.39
▸ ADRB3 P13945 1/20 0.39
▸ MAOA P21397 2/20 0.38
▸ MAOB P27338 2/20 0.38
▸ CA12 O43570 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Hydrochloric Acid SCHEMBL27637035 0.98 EPHX2 (0.45) EPHX2TSHRTDP1GFERALDH1A1
SCHEMBL5839383 0.88 LTA4H (0.46) ALDH1A1CYP3A4LOXL2HTTCA2
SCHEMBL19050970 0.82 ESR1 (0.52) EPHX2ALDH1A1HTTCA2LTA4H
SCHEMBL8058539 0.82 TPSAB1 (0.45) TSHRLOXL2HTTCA2LTA4H
SCHEMBL18392595 0.81 EPHX2 (0.42) EPHX2TSHRTDP1GFERALDH1A1
SCHEMBL22507923 0.81 EPHX2 (0.42) EPHX2TSHRTDP1GFERALDH1A1
SCHEMBL22887096 0.79 LTA4H (0.41) ALDH1A1HTTCA2LTA4H
SCHEMBL3440203 0.79 LOXL2 (0.50) EPHX2CYP3A4LOXL2HTTCA2
SCHEMBL8040670 0.79 CHRM2 (0.47) ALDH1A1HTTLTA4H
SCHEMBL15961525 0.79 LMNA (0.48) ALDH1A1HTTCA2LTA4H

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023091565-A1 NSD2-TARGETED CHEMICAL DEGRADERS AND COMPOSITIONS AND METHODS OF USE THEREOF THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2023-05-25 — — WO disclosed
US-11059801-B2 Methods to induce targeted protein degradation through bifunctional molecules DANA-FARBER CANCER INSTITUTE, INC. (US) 2021-07-13 — — US disclosed
US-20200317635-A1 METHODS TO INDUCE TARGETED PROTEIN DEGRADATION THROUGH BIFUNCTIONAL MOLECULES DANA-FARBER CANCER INSTITUTE, INC. (US) 2020-10-08 — — US disclosed
US-10669253-B2 Methods to induce targeted protein degradation through bifunctional molecules DANA-FARBER CANCER INSTITUTE, INC. (US) 2020-06-02 — — US disclosed
US-10464925-B2 Methods to induce targeted protein degradation through bifunctional molecules DANA-FARBER CANCER INSTITUTE, INC. (US) 2019-11-05 — — US disclosed
US-20190071415-A1 METHODS TO INDUCE TARGETED PROTEIN DEGRADATION THROUGH BIFUNCTIONAL MOLECULES DANA-FARBER CANCER INSTITUTE, INC. (US) 2019-03-07 — — US disclosed
US-20180134684-A1 METHODS TO INDUCE TARGETED PROTEIN DEGRADATION THROUGH BIFUNCTIONAL MOLECULES DANA-FARBER CANCER INSTITUTE, INC. (US) 2018-05-17 — — US disclosed
US-20180134684-A1 METHODS TO INDUCE TARGETED PROTEIN DEGRADATION THROUGH BIFUNCTIONAL MOLECULES DANA-FARBER CANCER INSTITUTE, INC. (US) 2018-05-17 — — US disclosed
US-9914740-B2 Tricyclic pyrido-carboxamide derivatives as rock inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2018-03-13 — — US disclosed
US-9914740-B2 Tricyclic pyrido-carboxamide derivatives as rock inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2018-03-13 — — US disclosed
US-20170014523-A1 SPLICEOSTATIN ANALOGS AND METHOS FOR THEIR PREPARATION PFIZER (US) 2017-01-19 — — US disclosed
US-20170014523-A1 SPLICEOSTATIN ANALOGS AND METHOS FOR THEIR PREPARATION PFIZER (US) 2017-01-19 — — US disclosed
US-9504669-B2 Spliceostatin analogs and methods for their preparation PFIZER INC. (US) 2016-11-29 — — US disclosed
US-20160152628-A1 TRICYCLIC PYRIDO-CARBOXAMIDE DERIVATIVES AS ROCK INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2016-06-02 — — US disclosed
US-20160022626-A1 SPLICEOSTATIN ANALOGS AND METHODS FOR THEIR PREPARATION PFIZER (US) 2016-01-28 — — US disclosed
US-9169264-B2 Spliceostatin analogs and methods for their preparation PFIZER INC. (US) 2015-10-27 — — US disclosed
US-20140134193-A1 SPLICEOSTATIN ANALOGS AND METHODS FOR THEIR PREPARATION PFIZER INC. (US) 2014-05-15 — — US disclosed
EP-1313732-B1 OXINDOLE DERIVATIVES GLAXO GROUP LTD (GB) 2004-11-03 — — EP disclosed
EP-1313732-A1 OXINDOLE DERIVATIVES GLAXO GROUP LIMITED (GB) 2003-05-28 — — EP disclosed
WO-2002020524-A1 OXINDOLE DERIVATIVES GLAXO GROUP LIMITED (GB) 2002-03-14 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (10 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160022626-A1 SPLICEOSTATIN ANALOGS AND METHODS FOR THEIR PREPARATION SF3B5, SNRPA1, SF3B1 EPHX2 3793/4885TSHR 2101/4885TDP1 2250/4885
US-20190071415-A1 METHODS TO INDUCE TARGETED PROTEIN DEGRADATION THROUGH BIFUNCTIONAL MOLECULES CRBN, MDM2, MYCBP EPHX2 2741/4885TSHR 3028/4885TDP1 3319/4885
US-20160152628-A1 TRICYCLIC PYRIDO-CARBOXAMIDE DERIVATIVES AS ROCK INHIBITORS MYLK, MYLK2, ROCK1 EPHX2 2227/4885TSHR 2274/4885TDP1 134/4885
US-11059801-B2 Methods to induce targeted protein degradation through bifunctional molecules CRBN, XIAP, MDM2 EPHX2 2903/4885TSHR 3312/4885TDP1 3884/4885
US-10464925-B2 Methods to induce targeted protein degradation through bifunctional molecules CRBN, MDM2, MYCBP EPHX2 2741/4885TSHR 3028/4885TDP1 3319/4885
US-20140134193-A1 SPLICEOSTATIN ANALOGS AND METHODS FOR THEIR PREPARATION SF3B5, SNRPA1, SF3B1 EPHX2 3793/4885TSHR 2101/4885TDP1 2250/4885
US-20170014523-A1 SPLICEOSTATIN ANALOGS AND METHOS FOR THEIR PREPARATION SF3B5, SF3B1, SNRPA1 EPHX2 4076/4885TSHR 947/4885TDP1 2487/4885
US-10669253-B2 Methods to induce targeted protein degradation through bifunctional molecules CRBN, SMARCE1, MDM2 EPHX2 1831/4885TSHR 3723/4885TDP1 3145/4885
US-20200317635-A1 METHODS TO INDUCE TARGETED PROTEIN DEGRADATION THROUGH BIFUNCTIONAL MOLECULES CRBN, MDM2, MYCBP EPHX2 2741/4885TSHR 3028/4885TDP1 3319/4885
US-20180134684-A1 METHODS TO INDUCE TARGETED PROTEIN DEGRADATION THROUGH BIFUNCTIONAL MOLECULES CRBN, MDM2, MYCBP EPHX2 2741/4885TSHR 3028/4885TDP1 3319/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

Send feedback