SCHEMBL383037

SCHEMBL383037

O=Cc1ccc(N2CCC(Nc3ncccn3)CC2)cc1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 8/20 0.53
▸ DRD3 P35462 8/20 0.53
▸ TRIM24 O15164 1/20 0.49
▸ TRIM33 Q9UPN9 1/20 0.49
▸ ALDH1A1 P00352 3/20 0.47
▸ KDM4E B2RXH2 2/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ MAPK1 P28482 1/20 0.46
▸ GAA P10253 1/20 0.45
▸ METAP1 P53582 1/20 0.42

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
SCHEMBL31736836 0.85 TRIM24 (0.45) DRD2DRD3TRIM24TRIM33ALDH1A1
SCHEMBL383016 0.80 DRD2 (0.55) DRD2DRD3KDM4EMAPK1GAA
SCHEMBL383328 0.78 DRD2 (0.51) DRD2DRD3ALDH1A1KDM4EMAPK1
SCHEMBL383329 0.78 DRD2 (0.51) DRD2DRD3MAPK1
SCHEMBL382518 0.78 DRD2 (0.53) DRD2DRD3KDM4EMAPK1GAA
SCHEMBL7660354 0.74 MAPT (0.62) TRIM24TRIM33ALDH1A1KDM4ESMN1; SMN2
SCHEMBL382510 0.73 NOS2 (0.51) DRD2DRD3ALDH1A1KDM4EMAPK1
SCHEMBL31737288 0.73 ALDH1A1 (0.41) TRIM24TRIM33ALDH1A1KDM4ESMN1; SMN2
SCHEMBL383181 0.72 CASR (0.54) DRD2DRD3METAP1
SCHEMBL382583 0.72 CASR (0.54) DRD2DRD3METAP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1074543-B1 AMINOPIPERIDINE DERIVATIVES AS INTEGRIN ALPHA V BETA 3 ANTAGONISTS MEIJI SEIKA PHARMA CO LTD (JP) 2012-01-25 — — EP disclosed
CN-1140511-C As integrin alphavβ3Aminopiperidine derivatives as antagonists �����Ƹ���ʽ���� 2004-03-03 — — CN disclosed
US-6420558-B1 COMPOUNDS WITH AMIDINE GROUPS ANTAGONISTIC ACTIVITY, CELL ADHESION INHIBITORY ACTIVITY, HUMAN PLATELET AGGREGATION INHIBITORY ACTIVITY, AND THERAPEUTIC AGENTS MEIJI SEIKA KAISHA, LTD. (JP) 2002-07-16 — — US disclosed
CN-1303377-A Amino piperidine derivatives as integrin alpha beta 3 antagonists MEIJI SEIKA KAISHA (JP) 2001-07-11 — — CN disclosed
EP-1074543-A1 AMINOPIPERIDINE DERIVATIVES AS INTEGRIN ALPHA V BETA 3 ANTAGONISTS MEIJI SEIKA KAISHA LTD. (JP) 2001-02-07 — — EP disclosed
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