SCHEMBL10832490

SCHEMBL10832490

COc1cc(C(=O)N2CCN/C2=N\c2c(Cl)cccc2Cl)ccc1C

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 9/20 0.40
▸ MAPT P10636 2/20 0.40
▸ GAA P10253 1/20 0.40
▸ ATM Q13315 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ POLB P06746 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ HPGD P15428 1/20 0.38
▸ SPTLC2 O15270 1/20 0.38
▸ ALDH1A1 P00352 2/20 0.37
▸ PDE4A P27815 1/20 0.37
▸ PDE4B Q07343 1/20 0.37
▸ PDE4C Q08493 1/20 0.37
▸ PDE4D Q08499 1/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ LMNA P02545 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
SCHEMBL10832493 1.00 HSD11B1 (0.40) HSD11B1MAPTGAAATMSMN1; SMN2
SCHEMBL10832468 0.92 PDE4D (0.45) MAPTGAAATMSMN1; SMN2POLB
SCHEMBL10832466 0.92 PDE4D (0.45) MAPTGAAATMSMN1; SMN2POLB
SCHEMBL10831654 0.90 SMN1; SMN2 (0.47) MAPTGAAATMSMN1; SMN2POLB
SCHEMBL10831650 0.90 SMN1; SMN2 (0.47) MAPTGAAATMSMN1; SMN2POLB
SCHEMBL10832630 0.88 ALDH1A1 (0.46) GAAPOLBALDH1A1MEN1LMNA
SCHEMBL10832636 0.88 ALDH1A1 (0.46) GAAPOLBALDH1A1MEN1LMNA
SCHEMBL10832451 0.84 GPR6 (0.45) MAPTGAASMN1; SMN2POLBHPGD
SCHEMBL10832289 0.83 GPR6 (0.43) MAPTSMN1; SMN2TDP1ALDH1A1KMT2A
SCHEMBL10832293 0.83 GPR6 (0.43) MAPTSMN1; SMN2TDP1ALDH1A1KMT2A

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-4581460-A ANALGESICS CHEMIE LINZ AKTIENGESELLSCHAFT (AT) 1986-04-08 — — US disclosed
EP-0083729-B1 SUBSTITUTED 1-BENZOYL-2-PHENYLIMINO-IMIDAZOLIDINES, THEIR ACID ADDITION SALTS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM CHEMIE LINZ AKTIENGESELLSCHAFT (AT) 1986-02-26 — — EP disclosed
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