SCHEMBL6957862

SCHEMBL6957862

CC(=O)O[CH]c1ccc(Br)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.43
MAPT P10636 5/20 0.43
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
NPSR1 Q6W5P4 3/20 0.43
MAPK1 P28482 2/20 0.43
S1PR4 O95977 1/20 0.43
S1PR1 P21453 1/20 0.43
MAOB P27338 3/20 0.40
MAOA P21397 2/20 0.40
RAB9A P51151 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
NPC1 O15118 2/20 0.39
RECQL P46063 1/20 0.39
TSHR P16473 2/20 0.39
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
CYP2C9 P11712 3/20 0.39
CYP2C19 P33261 3/20 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
SCHEMBL87638 0.78 TDP1 (0.48) LMNAMAPTMEN1KMT2ANPSR1
SCHEMBL8972017 0.76 CYP1A2 (0.52) LMNAMAPTMEN1KMT2ARAB9A
SCHEMBL5694593 0.72 IAPP (0.55) LMNAMAPTMEN1KMT2AMAPK1
SCHEMBL9341839 0.71 MAPT (0.69) LMNAMAPTMEN1KMT2ANPSR1
SCHEMBL9341842 0.71 MAPT (0.69) LMNAMAPTMEN1KMT2ANPSR1
SCHEMBL9998235 0.69 MAPT (0.53) LMNAMAPTMEN1KMT2ANPSR1
SCHEMBL9998233 0.69 MAPT (0.53) LMNAMAPTMEN1KMT2ANPSR1
SCHEMBL502894 0.69 AKR1C3 (0.53) LMNAMAPTMEN1KMT2ANPSR1
SCHEMBL502895 0.69 AKR1C3 (0.53) LMNAMAPTMEN1KMT2ANPSR1
SCHEMBL9997472 0.68 KMT2A (0.45) LMNAMAPTMEN1KMT2ANPSR1

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
EP-1329160-A2 4-ACYLAMINOPYRAZOLE DERIVATIVES Sankyo Company, Limited (JP) 2003-07-23 EP disclosed