SCHEMBL383205

SCHEMBL383205

COC(=O)c1ccc(N2CCC(O)CC2)c(OC)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.57
ALDH1A1 P00352 4/20 0.57
NPC1 O15118 3/20 0.57
KDM4E B2RXH2 2/20 0.57
RAB9A P51151 2/20 0.57
HPGD P15428 2/20 0.57
SMN1; SMN2 Q16637 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
KMT2A Q03164 3/20 0.46
MEN1 O00255 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
ALOX15 P16050 1/20 0.46
HSD17B10 Q99714 1/20 0.46
TP53 P04637 1/20 0.45
TSHR P16473 1/20 0.45
TAF1 P21675 1/20 0.44
FFAR2 O15552 2/20 0.43
TUBB4A P04350 1/20 0.43
TUBB P07437 1/20 0.43

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
SCHEMBL12643734 0.89 MAPT (0.72) MAPTALDH1A1NPC1KDM4ERAB9A
SCHEMBL38659323 0.88 MAPT (0.60) MAPTALDH1A1NPC1KDM4ERAB9A
SCHEMBL1664284 0.88 KDM4E (0.52) MAPTALDH1A1NPC1KDM4ERAB9A
SCHEMBL382089 0.85 MAPT (0.51) MAPTALDH1A1NPC1KDM4ERAB9A
SCHEMBL382272 0.85 ALDH1A1 (0.59) MAPTALDH1A1NPC1KDM4ERAB9A
SCHEMBL1096145 0.85 ALDH1A1 (0.59) MAPTALDH1A1NPC1KDM4ERAB9A
SCHEMBL381764 0.84 HPGD (0.57) MAPTALDH1A1NPC1KDM4ERAB9A
SCHEMBL6597425 0.82 ALDH1A1 (0.56) MAPTALDH1A1NPC1KDM4ERAB9A
SCHEMBL6273824 0.82 NPC1 (0.52) MAPTALDH1A1NPC1KDM4ERAB9A
SCHEMBL6508563 0.81 KDM4E (0.54) MAPTALDH1A1NPC1KDM4ERAB9A

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 4 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
EP-1074543-A1 AMINOPIPERIDINE DERIVATIVES AS INTEGRIN ALPHA V BETA 3 ANTAGONISTS MEIJI SEIKA KAISHA LTD. (JP) 2001-02-07 EP disclosed