SCHEMBL9738267

SCHEMBL9738267

Cc1c(C)n(Cc2ccccc2)c2c(S(C)(=O)=O)nncc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FABP4 P15090 1/20 0.47
MAPT P10636 1/20 0.41
KMT2A Q03164 4/20 0.40
MEN1 O00255 3/20 0.40
TSHR P16473 3/20 0.40
KDM4E B2RXH2 3/20 0.40
LMNA P02545 3/20 0.40
NPSR1 Q6W5P4 2/20 0.40
ALDH1A1 P00352 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C19 P33261 1/20 0.40
POLB P06746 1/20 0.40
THRB P10828 1/20 0.40
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
NR2F2 P24468 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
PTGDR2 Q9Y5Y4 1/20 0.37
MAPK1 P28482 2/20 0.36
HTT P42858 1/20 0.36

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
SCHEMBL9754273 0.80 FABP4 (0.49) FABP4MAPTKMT2AMEN1TSHR
SCHEMBL9738200 0.79 FABP4 (0.48) FABP4MAPTKMT2AMEN1TSHR
SCHEMBL9740226 0.77 FABP4 (0.46) FABP4MAPTKMT2AMEN1TSHR
SCHEMBL9738063 0.75 CYP1A2 (0.46) FABP4MAPTKMT2AMEN1TSHR
SCHEMBL9737913 0.73 FABP4 (0.43) FABP4MAPTKMT2AMEN1TSHR
SCHEMBL8314414 0.70 MAPT (0.49) FABP4MAPTKMT2AMEN1TSHR
SCHEMBL9740097 0.70 KDM4E (0.67) FABP4MAPTKMT2AMEN1TSHR
SCHEMBL9738145 0.70 CYP1A2 (0.42) FABP4MAPTKMT2AMEN1TSHR
SCHEMBL9739195 0.70 CYP1A2 (0.48) FABP4MAPTKMT2AMEN1KDM4E
SCHEMBL9738417 0.70 CYP1A2 (0.46) FABP4MAPTKMT2AMEN1TSHR

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-1992006979-A1 NEW DIAZINES BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1992-04-30 WO disclosed