SCHEMBL30711199

SCHEMBL30711199

COC(=O)c1ccc(C2CC(c3cn(C)nn3)CCN2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 1/20 0.40
▸ CACNA1C Q13936 1/20 0.40
▸ HSD17B10 Q99714 4/20 0.40
▸ TSHR P16473 4/20 0.40
▸ KDM4E B2RXH2 4/20 0.40
▸ ALDH1A1 P00352 4/20 0.40
▸ CASP1 P29466 3/20 0.40
▸ GAA P10253 2/20 0.40
▸ HPGD P15428 2/20 0.40
▸ CASP7 P55210 2/20 0.40
▸ ATM Q13315 2/20 0.40
▸ HTT P42858 2/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ POLB P06746 1/20 0.35
▸ GLA P06280 1/20 0.35
▸ NPC1 O15118 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ DDB1 Q16531 1/20 0.33

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
SCHEMBL30711337 0.83 TSHR (0.41) HSD17B10TSHRKDM4EALDH1A1CASP1
SCHEMBL30711239 0.80 TSHR (0.39) HSD17B10TSHRKDM4EALDH1A1CASP1
SCHEMBL30711296 0.80 ALDH1A1 (0.38) EPHX2HSD17B10TSHRKDM4EALDH1A1
SCHEMBL30711242 0.78 KDM4E (0.42) HSD17B10TSHRKDM4EALDH1A1CASP1
SCHEMBL30711276 0.78 ALDH1A1 (0.41) HSD17B10TSHRKDM4EALDH1A1CASP1
SCHEMBL31465098 0.77 KDM4E (0.38) HSD17B10TSHRKDM4EALDH1A1CASP1
SCHEMBL30711177 0.77 KDM4E (0.40) HSD17B10TSHRKDM4EALDH1A1CASP1
SCHEMBL25076786 0.77 GRIN2B (0.47) HSD17B10TSHRKDM4EALDH1A1CASP1
SCHEMBL25076785 0.77 GRIN2B (0.47) HSD17B10TSHRKDM4EALDH1A1CASP1
SCHEMBL29213808 0.77 GRIN2B (0.47) HSD17B10TSHRKDM4EALDH1A1CASP1

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
CN-119698414-A Indole-phenyl piperidine compound and preparation method and application thereof 深圳信立泰药业股份有限公司 2025-03-25 — — CN disclosed
WO-2023246677-A1 INDOLE-PHENYLPIPERIDINE COMPOUND, METHOD FOR PREPARING SAME, AND USE THEREOF 深圳信立泰药业股份有限公司 2023-12-28 — — WO disclosed
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