SCHEMBL9201299

SCHEMBL9201299

Cc1cc(Br)ccc1-c1c[nH]c(S)n1

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.32
NOS1 P29475 1/20 0.32
METAP2 P50579 1/20 0.32
DYRK1A Q13627 1/20 0.32
NPC1 O15118 2/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
MAPT P10636 1/20 0.32
KMT2A Q03164 1/20 0.32
ATM Q13315 1/20 0.32
CCNB2 O95067 2/20 0.31
CDK1 P06493 2/20 0.31
CCNB1 P14635 2/20 0.31
PRKACA P17612 2/20 0.31
PRKACG P22612 2/20 0.31
PRKACB P22694 2/20 0.31
CSNK1A1 P48729 2/20 0.31
CSNK1D P48730 2/20 0.31
CSNK1E P49674 2/20 0.31
CLK1 P49759 2/20 0.31

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
SCHEMBL8699164 0.76 IDO1 (0.44) METAP2NPC1KDM4EMEN1MAPT
SCHEMBL20054201 0.75 CHRNB2 (0.33) FFAR1AGPAT2ALDH1A1CRHR1
SCHEMBL2945910 0.70 S100A4 (0.46) FFAR1ALDH1A1AHRCYP2A6
SCHEMBL18268298 0.66 S100A4 (0.42) FFAR1ALDH1A1CYP2A6
SCHEMBL5305952 0.66 NPC1 (0.41) NPC1KDM4EMEN1MAPTKMT2A
SCHEMBL27031500 0.65 NT5E (0.37) FFAR1KDM4ECRHR1
SCHEMBL5914842 0.65 ADRA2A (0.49) KDM4EMEN1KMT2ACSNK1A1ALDH1A1
SCHEMBL8744731 0.64 HSP90AB1 (0.45) NPC1KDM4EMEN1MAPTKMT2A
SCHEMBL19180559 0.63 PTPRC (0.46) NPC1CYP1A2ALDH1A1RAB9ASMN1; SMN2
SCHEMBL30414134 0.63 ESR2 (0.42) NPC1MEN1KMT2AALDH1A1RAB9A

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-0651747-A1 CARBOSTYRIL DERIVATIVES. OTSUKA PHARMA CO LTD (JP) 1995-05-10 EP disclosed
WO-1994026732-A1 CARBOSTYRIL DERIVATIVES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1994-11-24 WO disclosed