SCHEMBL15775343

SCHEMBL15775343

COc1cccc(C(N)=O)c1NC(=O)c1ccc(Cl)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.58
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
MAPT P10636 4/20 0.54
ALDH1A1 P00352 1/20 0.54
F10 P00742 2/20 0.53
KDM4E B2RXH2 2/20 0.53
NPSR1 Q6W5P4 1/20 0.53
PARP1 P09874 1/20 0.53
PARP2 Q9UGN5 1/20 0.53
NPC1 O15118 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
HDAC1 Q13547 1/20 0.48
HDAC8 Q9BY41 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48
GRM5 P41594 1/20 0.47
KCNK3 O14649 1/20 0.46
KCNK9 Q9NPC2 1/20 0.46
ATM Q13315 1/20 0.46
RXFP1 Q9HBX9 2/20 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
SCHEMBL167021 0.88 SMN1; SMN2 (0.57) MEN1KMT2AMAPTALDH1A1KDM4E
SCHEMBL15775208 0.88 RAB9A (0.58) LMNAKMT2AMAPTALDH1A1KDM4E
SCHEMBL7574902 0.88 TP53 (0.55) MEN1KMT2AMAPTALDH1A1F10
SCHEMBL7028467 0.88 KCNK3 (0.59) LMNAMEN1KMT2AMAPTALDH1A1
SCHEMBL15775483 0.87 ALDH1A1 (0.54) LMNAMEN1KMT2AMAPTALDH1A1
SCHEMBL15775203 0.85 TAS1R3 (0.47) LMNAMEN1KMT2AMAPTNPC1
SCHEMBL7570311 0.83 KMT2A (0.54) LMNAMEN1KMT2AMAPTALDH1A1
SCHEMBL15775229 0.82 KDM4E (0.57) LMNAMEN1KMT2AALDH1A1F10
SCHEMBL10179323 0.80 F10 (0.69) MEN1KMT2AF10NPC1SMN1; SMN2
SCHEMBL7018503 0.79 MAPK1 (0.51) LMNAMEN1KMT2AMAPTALDH1A1

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