SCHEMBL15775229

SCHEMBL15775229

Cc1cccc(C(N)=O)c1NC(=O)c1ccc(Cl)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.57
HTT P42858 2/20 0.55
NPC1 O15118 1/20 0.55
ALDH1A1 P00352 1/20 0.55
RAB9A P51151 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
RXFP1 Q9HBX9 1/20 0.49
LMNA P02545 1/20 0.48
PARP1 P09874 1/20 0.47
PARP2 Q9UGN5 1/20 0.47
KCNK3 O14649 1/20 0.47
POLB P06746 2/20 0.47
F10 P00742 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C19 P33261 1/20 0.46
KMT2A Q03164 2/20 0.46
TRPV1 Q8NER1 1/20 0.45
S1PR4 O95977 1/20 0.45
CDC7 O00311 1/20 0.44
PLK4 O00444 1/20 0.44

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
SCHEMBL15775319 0.88 KDM4E (0.59) KDM4EHTTNPC1ALDH1A1RAB9A
SCHEMBL15775601 0.87 KDM4E (0.61) KDM4EALDH1A1LMNAKCNK3POLB
SCHEMBL11123393 0.86 RXFP1 (0.59) KDM4EHTTNPC1ALDH1A1RAB9A
SCHEMBL15775402 0.86 KDM4E (0.77) KDM4ENPC1RAB9ASMN1; SMN2LMNA
SCHEMBL15775437 0.86 KDM4E (0.57) KDM4ENPC1RAB9ASMN1; SMN2PARP1
SCHEMBL15775332 0.83 ALDH1A1 (0.55) KDM4ENPC1ALDH1A1RAB9ASMN1; SMN2
SCHEMBL15775220 0.83 KDM4E (0.58) KDM4ENPC1RAB9ASMN1; SMN2RXFP1
SCHEMBL15775343 0.82 LMNA (0.58) KDM4ENPC1ALDH1A1SMN1; SMN2RXFP1
SCHEMBL15775205 0.81 RORC (0.54) KDM4EHTTNPC1ALDH1A1RAB9A
SCHEMBL9522953 0.80 S1PR4 (0.56) KDM4EHTTNPC1ALDH1A1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2014087165-A1 TANKYRASE INHIBITORS UNIVERSITY OF BATH (GB) 2014-06-12 WO disclosed