SCHEMBL23844240

SCHEMBL23844240

CC(C)c1ccc(N2CCC(C(C)C)C2)cc1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 1/20 0.44
▸ NOTUM Q6P988 3/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ LMNA P02545 1/20 0.40
▸ L3MBTL1 Q9Y468 2/20 0.39
▸ ACACB O00763 9/20 0.39
▸ HPGD P15428 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ ALOX12 P18054 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37

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
SCHEMBL10118804 0.89 HRH3 (0.49) HRH3ALDH1A1LMNAL3MBTL1HPGD
SCHEMBL19368254 0.83 NOTUM (0.51) HRH3NOTUMALDH1A1LMNAKDM4E
SCHEMBL23844510 0.82 NOTUM (0.50) NOTUMALDH1A1L3MBTL1ACACBKDM4E
SCHEMBL25016625 0.81 HRH3 (0.45) HRH3NOTUMALDH1A1LMNAL3MBTL1
SCHEMBL25017269 0.81 HRH3 (0.45) HRH3NOTUMALDH1A1LMNAL3MBTL1
SCHEMBL24352429 0.79 CCR6 (0.49) HRH3NOTUMALDH1A1LMNAACACB
SCHEMBL24352423 0.79 CCR6 (0.49) HRH3NOTUMALDH1A1LMNAACACB
SCHEMBL23959393 0.79 HRH4 (0.46) HRH3NOTUMALDH1A1L3MBTL1ACACB
SCHEMBL23844192 0.79 MCHR1 (0.48) ALDH1A1KMT2A
SCHEMBL24481511 0.79 NOTUM (0.55) NOTUMLMNAL3MBTL1MAPTALOX12

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220169631-A9 TAIRE FAMILY KINASE INHIBITORS AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2022-06-02 — — US disclosed
US-20210292299-A1 TAIRE FAMILY KINASE INHIBITORS AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2021-09-23 — — 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 (2 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-20220169631-A9 TAIRE FAMILY KINASE INHIBITORS AND USES THEREOF CDK14, CDK16, CDK19 HRH3 3055/4885NOTUM 3306/4885ALDH1A1 4421/4885
US-20210292299-A1 TAIRE FAMILY KINASE INHIBITORS AND USES THEREOF CDK14, CDK16, CDK19 HRH3 3055/4885NOTUM 3306/4885ALDH1A1 4421/4885

“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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