SCHEMBL27870337

SCHEMBL27870337

Cc1cc(O)cc(Br)c1NC(=O)c1cccc(C=O)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
UNG P13051 1/20 0.43
TP53 P04637 3/20 0.43
NPC1 O15118 3/20 0.43
RAB9A P51151 3/20 0.43
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
KDM4E B2RXH2 1/20 0.40
EGLN2 Q96KS0 1/20 0.40
ITGB3 P05106 1/20 0.39
ITGB1 P05556 1/20 0.39
ITGAV P06756 1/20 0.39
ITGA2B P08514 1/20 0.39
ITGB5 P18084 1/20 0.39
MAPT P10636 2/20 0.39
AKR1C4 P17516 1/20 0.39
AKR1C3 P42330 1/20 0.39
AKR1C2 P52895 1/20 0.39
AKR1C1 Q04828 1/20 0.39
ALDH1A1 P00352 1/20 0.39
ABL1 P00519 1/20 0.39

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
SCHEMBL1360526 0.82 KDM4E (0.56) TP53NPC1RAB9AMEN1KMT2A
SCHEMBL1361514 0.80 KMT2A (0.56) TP53NPC1RAB9AMEN1KMT2A
SCHEMBL27886604 0.78 TSHR (0.39) UNGTP53NPC1RAB9AMEN1
SCHEMBL1361740 0.78 ALDH1A1 (0.60) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL10042085 0.76 TP53 (0.63) UNGTP53NPC1RAB9AMEN1
SCHEMBL15652364 0.74 NPC1 (0.61) UNGTP53NPC1RAB9AMEN1
SCHEMBL27480739 0.72 UNG (0.56) UNGTP53NPC1RAB9AMEN1
SCHEMBL9454755 0.72 HDAC1 (0.63) UNGNPC1RAB9AMEN1KMT2A
SCHEMBL15651552 0.72 HTR1D (0.58) TP53NPC1RAB9AMEN1KMT2A
SCHEMBL27210087 0.71 HDAC1 (0.65) UNGKDM4EEGLN2ALDH1A1HDAC3

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
CN-101203484-B Amide derivative and pesticide containing such compound MITSU CHEMICALS INC 2012-09-05 CN disclosed