SCHEMBL8987310

SCHEMBL8987310

CCCCCC=Cc1cc(-c2ccccc2)c2ccccc2n1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.56
L3MBTL1 Q9Y468 2/20 0.56
MEN1 O00255 1/20 0.56
USP2 O75604 1/20 0.56
ALDH1A1 P00352 1/20 0.56
MAPK1 P28482 1/20 0.56
CTNNB1 P35222 1/20 0.56
KMT2A Q03164 1/20 0.56
ATM Q13315 1/20 0.56
RXFP1 Q9HBX9 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
ACACA Q13085 3/20 0.40
EGFR P00533 1/20 0.40
KDM4E B2RXH2 1/20 0.40
POLB P06746 1/20 0.40
RAB9A P51151 1/20 0.40
LTB4R Q15722 4/20 0.39
FAAH O00519 2/20 0.39
CES1 P23141 1/20 0.39
ACP1 P24666 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
SCHEMBL8987305 1.00 MAPT (0.56) MAPTL3MBTL1MEN1USP2ALDH1A1
SCHEMBL8987018 0.84 LTB4R (0.57) MAPTL3MBTL1MEN1USP2ALDH1A1
SCHEMBL8987023 0.84 LTB4R (0.57) MAPTL3MBTL1MEN1USP2ALDH1A1
SCHEMBL9119169 0.82 MAPT (0.44) MAPTL3MBTL1USP2ALDH1A1KDM4E
SCHEMBL9119173 0.82 MAPT (0.44) MAPTL3MBTL1USP2ALDH1A1KDM4E
SCHEMBL21065452 0.78 MAPT (0.47) MAPTMEN1ALDH1A1KMT2ATDP1
SCHEMBL21065451 0.78 MAPT (0.47) MAPTMEN1ALDH1A1KMT2ATDP1
SCHEMBL21065450 0.78 MAPT (0.47) MAPTMEN1ALDH1A1KMT2ATDP1
SCHEMBL30271653 0.75 MAPT (0.44) MAPTMEN1ALDH1A1KMT2ATDP1
SCHEMBL21128448 0.75 MAPT (0.44) MAPTMEN1ALDH1A1KMT2ATDP1

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
US-5492915-A ANTIINFLAMMATORY AGENTS RHONE-POULENC RORER S.A. (FR) 1996-02-20 US disclosed