SCHEMBL9768405

SCHEMBL9768405

O=c1[nH]c2cc(OCC(O)CN3CCOCC3)ccc2c2oc3cc(OCC(O)CN4CCOCC4)ccc3c12

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
ALDH1A1 P00352 3/20 0.52
GAA P10253 2/20 0.52
KDM4E B2RXH2 2/20 0.52
KMT2A Q03164 2/20 0.52
MEN1 O00255 1/20 0.52
MAPK1 P28482 3/20 0.51
USP2 O75604 2/20 0.50
MAPT P10636 2/20 0.50
HPGD P15428 2/20 0.50
HSD17B10 Q99714 2/20 0.50
TSHR P16473 1/20 0.50
LMNA P02545 1/20 0.49
KCNH2 Q12809 1/20 0.49
PKM P14618 1/20 0.47
ABCB1 P08183 3/20 0.46

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
SCHEMBL9768406 0.94 SMN1; SMN2 (0.52) L3MBTL1SMN1; SMN2ALDH1A1GAAKDM4E
SCHEMBL9768414 0.78 ADRB2 (0.47) MAPT
SCHEMBL9768419 0.77 MAOB (0.59) ALDH1A1KDM4EMAPTHPGD
SCHEMBL9768407 0.74 RAD52 (0.46)
SCHEMBL10669694 0.73 CA12 (0.43)
SCHEMBL9768425 0.72 ADRB2 (0.46) MAPT
SCHEMBL10486594 0.72 PKM (0.60) L3MBTL1SMN1; SMN2ALDH1A1GAAKDM4E
SCHEMBL4578170 0.72 USP2 (0.83) L3MBTL1SMN1; SMN2ALDH1A1GAAKDM4E
SCHEMBL9768428 0.72 ALDH1A1 (0.42) L3MBTL1SMN1; SMN2ALDH1A1GAAKDM4E
SCHEMBL10670024 0.70 KDM4E (0.51) L3MBTL1ALDH1A1KDM4EKMT2AMEN1

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-5073553-A Treatment or prevention of osteoporosis KISSEI PHARMACEUTICAL CO., LTD. (JP) 1991-12-17 US disclosed
EP-0370760-A2 Benzofuro[3,2-c]quinoline compounds Kissei Pharmaceutical Co., Ltd. (JP) 1990-05-30 EP disclosed