SCHEMBL9137686

SCHEMBL9137686

CC(C)/N=C(\Cl)c1ccc(Cl)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 2/20 0.43
▸ TSHR P16473 2/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ ATM Q13315 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ LMNA P02545 5/20 0.42
▸ CYP1A2 P05177 1/20 0.42
▸ ADRA2A P08913 1/20 0.42
▸ CYP2D6 P10635 1/20 0.42
▸ DRD1 P21728 1/20 0.42
▸ SLC6A2 P23975 1/20 0.42
▸ SLC6A4 P31645 1/20 0.42
▸ SLC6A3 Q01959 1/20 0.42
▸ KCNH2 Q12809 1/20 0.42
▸ ALDH1A1 P00352 2/20 0.41
▸ MAPT P10636 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ CES2 O00748 3/20 0.39
▸ CES1 P23141 3/20 0.39
▸ POLB P06746 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
SCHEMBL9137695 1.00 CYP3A4 (0.43) CYP3A4TSHRMAPK1ATML3MBTL1
SCHEMBL1085516 0.80 KMT2A (0.40) CYP3A4TSHRATMLMNAADRA2A
SCHEMBL1085514 0.80 KMT2A (0.40) CYP3A4TSHRATMLMNAADRA2A
SCHEMBL24769300 0.80 ESR1 (0.44) CYP3A4TSHRMAPK1ATML3MBTL1
SCHEMBL9132542 0.78 TSHR (0.44) TSHRADRA2ADRD1SLC6A2SLC6A4
SCHEMBL9132551 0.78 TSHR (0.44) TSHRADRA2ADRD1SLC6A2SLC6A4
SCHEMBL9133338 0.78 ALDH1A1 (0.50) TSHRMAPK1LMNAALDH1A1MAPT
SCHEMBL9133343 0.78 ALDH1A1 (0.50) TSHRMAPK1LMNAALDH1A1MAPT
SCHEMBL6560344 0.76 TSHR (0.38) CYP3A4TSHRMAPK1ATML3MBTL1
SCHEMBL15944877 0.75 CA1 (0.50) TSHRL3MBTL1LMNAALDH1A1MAPT

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
US-10342781-B2 Diazole amides CHEMOCENTRYX, INC. (US) 2019-07-09 — — US disclosed
US-10342781-B2 Diazole amides CHEMOCENTRYX, INC. (US) 2019-07-09 — — US disclosed
US-20180071257-A1 DIAZOLE AMIDES CHEMOCENTRYX, INC. 2018-03-15 — — US disclosed
US-20180071257-A1 DIAZOLE AMIDES CHEMOCENTRYX, INC. 2018-03-15 — — US disclosed
US-20180071257-A1 DIAZOLE AMIDES CHEMOCENTRYX, INC. 2018-03-15 — — US disclosed
EP-2935227-B1 DIAZOLE AMIDES AS CCR1 RECEPTOR ANTAGONISTS CHEMOCENTRYX INC (US) 2017-09-13 — — EP disclosed
EP-2935227-B1 DIAZOLE AMIDES AS CCR1 RECEPTOR ANTAGONISTS CHEMOCENTRYX INC (US) 2017-09-13 — — EP disclosed
US-9750722-B2 Diazole amides CHEMOCENTRYX, INC. (US) 2017-09-05 — — US disclosed
US-9750722-B2 Diazole amides CHEMOCENTRYX, INC. (US) 2017-09-05 — — US disclosed
US-9750722-B2 Diazole amides CHEMOCENTRYX, INC. (US) 2017-09-05 — — US disclosed
US-9169248-B2 Diazole amides CHEMOCENTRYX, INC. (US) 2015-10-27 — — US disclosed
US-9169248-B2 Diazole amides CHEMOCENTRYX, INC. (US) 2015-10-27 — — US disclosed
US-9169248-B2 Diazole amides CHEMOCENTRYX, INC. (US) 2015-10-27 — — US disclosed
US-20140228579-A1 METHOD FOR THE CATALYTIC REDUCTION OF ACID CHLORIDES AND IMIDOYL CHLORIDES Brock Unviersity (CA) 2014-08-14 — — US disclosed
US-20140228579-A1 METHOD FOR THE CATALYTIC REDUCTION OF ACID CHLORIDES AND IMIDOYL CHLORIDES Brock Unviersity (CA) 2014-08-14 — — US disclosed
US-20140179733-A1 DIAZOLE AMIDES CHEMOCENTRYX, INC. (US) 2014-06-26 — — US disclosed
US-20140179733-A1 DIAZOLE AMIDES CHEMOCENTRYX, INC. (US) 2014-06-26 — — US disclosed
WO-2014100735-A2 DIAZOLE AMIDES CHEMOCENTRYX, INC. (US) 2014-06-26 — — WO disclosed
US-20140179733-A1 DIAZOLE AMIDES CHEMOCENTRYX, INC. (US) 2014-06-26 — — US disclosed
US-5378702-A Thiadizinones MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1995-01-03 — — US 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 (4 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-20180071257-A1 DIAZOLE AMIDES CCR1, CCRL2, CCR4 CYP3A4 3192/4885TSHR 3054/4885MAPK1 2106/4885
US-10342781-B2 Diazole amides CCR1, CCRL2, CCR4 CYP3A4 3192/4885TSHR 3054/4885MAPK1 2106/4885
US-20140228579-A1 METHOD FOR THE CATALYTIC REDUCTION OF ACID CHLORIDES AND IMIDOYL CHLORIDES CA6, RUVBL2, HACL2 CYP3A4 3310/4885TSHR 3534/4885MAPK1 4412/4885
US-20140179733-A1 DIAZOLE AMIDES CCR1, CCRL2, CCR4 CYP3A4 3192/4885TSHR 3054/4885MAPK1 2106/4885

“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.

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