SCHEMBL4554551

SCHEMBL4554551

O=C(C(=O)N(c1ccccc1)c1ccc(OCCN2CCOCC2)cc1)c1c(-c2ccccc2)cc2ccccn12

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
PPARG P37231 6/20 0.44
POLB P06746 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
USP2 O75604 1/20 0.43
MCHR1 Q99705 1/20 0.43
LTA4H P09960 1/20 0.43
ALDH1A1 P00352 4/20 0.43
KMT2A Q03164 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
MAPT P10636 2/20 0.42
HRH3 Q9Y5N1 1/20 0.42
LMNA P02545 1/20 0.42
HTT P42858 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
SCHEMBL1647297 0.84 ALDH1A1 (0.58) KDM4ESMN1; SMN2NPC1RAB9APPARG
SCHEMBL7984046 0.74 USP2 (0.52) KDM4ESMN1; SMN2NPC1RAB9APOLB
SCHEMBL11877154 0.73 ALDH1A1 (0.59) KDM4ESMN1; SMN2NPC1RAB9ALTA4H
SCHEMBL1646027 0.71 SMN1; SMN2 (0.57) KDM4ESMN1; SMN2NPC1RAB9AL3MBTL1
SCHEMBL4639921 0.71 SMN1; SMN2 (0.61) KDM4ESMN1; SMN2NPC1RAB9AL3MBTL1
SCHEMBL1645710 0.70 SMN1; SMN2 (0.70) KDM4ESMN1; SMN2NPC1RAB9AL3MBTL1
SCHEMBL1645361 0.70 LMNA (0.61) SMN1; SMN2NPC1RAB9AL3MBTL1ALDH1A1
SCHEMBL1644958 0.70 EPHX2 (0.57) USP2ALDH1A1KMT2AMAPTLMNA
SCHEMBL11898739 0.69 NPC1 (0.97) NPC1RAB9ALTA4HHRH3
SCHEMBL1647385 0.69 SMN1; SMN2 (0.79) KDM4ESMN1; SMN2NPC1RAB9APOLB

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
EP-2097413-A1 2-[(2-SUBSTITUTED)-IND0LIZIN-3-YL]-2-OXO-ACETAMIDE DERIVATIVES AS ANTIFUNGAL AGENTS F2G Limited (GB) 2009-09-09 EP disclosed
WO-2008062182-A1 2- [ (2-SUBSTITUTED) -IND0LIZIN-3-YL] -2-OXO-ACETAMIDE DERIVATIVES AS ANTIFUNGAL AGENTS F2G LTD (GB) 2008-05-29 WO disclosed