SCHEMBL10832398

SCHEMBL10832398

O=C(c1cccc(F)c1)N1CCNC1=Nc1cccc(Cl)c1Cl

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 2/20 0.45
▸ HTT P42858 2/20 0.45
▸ MGLL Q99685 1/20 0.43
▸ GPR6 P46095 1/20 0.43
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ ALDH1A1 P00352 4/20 0.41
▸ ATM Q13315 1/20 0.41
▸ HSD11B1 P28845 1/20 0.41
▸ NPY2R P49146 1/20 0.40
▸ PLA2G7 Q13093 1/20 0.40
▸ DRD2 P14416 1/20 0.39
▸ DRD3 P35462 1/20 0.39
▸ USP2 O75604 1/20 0.38
▸ HPGD P15428 2/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ CYP2C9 P11712 1/20 0.37
▸ CYP2C19 P33261 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
SCHEMBL10831616 0.89 HSD11B1 (0.39) GAAMGLLGPR6HSD11B1DRD2
SCHEMBL10832716 0.88 GPR6 (0.45) GAAHTTMGLLGPR6SMN1; SMN2
SCHEMBL10832885 0.84 POLB (0.40) GAAMGLLGPR6
SCHEMBL10880573 0.84 POLB (0.40) GAAMGLLGPR6
SCHEMBL10831688 0.80 SLC6A7 (0.37) GAAALDH1A1DRD2DRD3CYP3A4
SCHEMBL10832587 0.80 SMN1; SMN2 (0.44) GAAMGLLGPR6SMN1; SMN2ALDH1A1
SCHEMBL10832323 0.79 PTGS2 (0.42) HTTMGLLALDH1A1
SCHEMBL10831829 0.79 MGLL (0.43) GAAHTTMGLLSMN1; SMN2ALDH1A1
SCHEMBL10831735 0.77 ALDH1A1 (0.45) GAAHTTALDH1A1HPGDTSHR
SCHEMBL10832129 0.77 NPC1 (0.47) GAAHTTSMN1; SMN2ALDH1A1HPGD

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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