SCHEMBL4350108

SCHEMBL4350108

CC(Oc1ccc(Cl)cc1-c1cc(C(N)=O)c(NC(N)=O)[nH]1)N1CCN(C)CC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 1/20 0.38
JAK2 O60674 4/20 0.37
MEN1 O00255 1/20 0.37
USP2 O75604 1/20 0.37
MAPK1 P28482 1/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
TDP1 Q9NUW8 1/20 0.36
ALDH1A1 P00352 1/20 0.36
BRD4 O60885 1/20 0.35
TSHR P16473 2/20 0.35
MAPT P10636 1/20 0.35
HSD17B10 Q99714 1/20 0.35
LMNA P02545 1/20 0.35
TP53 P04637 1/20 0.35
ALOX15 P16050 1/20 0.35
JAK1 P23458 1/20 0.35
RAB9A P51151 2/20 0.35
NPC1 O15118 1/20 0.35

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
SCHEMBL2198513 0.81 HTR2A (0.49) MEN1KMT2AALDH1A1
SCHEMBL4344137 0.80 BRD4 (0.43) SMN1; SMN2ALDH1A1BRD4RAB9ANPC1
SCHEMBL13685530 0.80 BRD4 (0.38) SLC9A1JAK2MEN1KMT2AL3MBTL1
SCHEMBL4357005 0.79 BRD4 (0.42) SMN1; SMN2ALDH1A1BRD4RAB9ANPC1
SCHEMBL2200930 0.79 JAK2 (0.52) SLC9A1JAK2MEN1KMT2AL3MBTL1
SCHEMBL4339928 0.78 CCNT1 (0.37) ALDH1A1BRD4
SCHEMBL4351733 0.78 BRD4 (0.41) SMN1; SMN2TDP1ALDH1A1BRD4TSHR
SCHEMBL4352395 0.77 BRD4 (0.42) JAK2MEN1KMT2AL3MBTL1TDP1
SCHEMBL2202819 0.76 MEN1 (0.46) SLC9A1JAK2MEN1USP2MAPK1
SCHEMBL2201104 0.75 HTR2A (0.42)

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-2116530-B1 NOVEL PYRROLE DERIVATIVE HAVING UREIDE GROUP AND AMINOCARBONYL GROUP AS SUBSTITUENTS SANTEN PHARMACEUTICAL CO LTD (JP) 2012-11-14 EP claimed
EP-2116530-A1 NOVEL PYRROLE DERIVATIVE HAVING UREIDE GROUP AND AMINOCARBONYL GROUP AS SUBSTITUENTS Santen Pharmaceutical Co., Ltd (JP) 2009-11-11 EP claimed