SCHEMBL9523489

SCHEMBL9523489

Cc1cc(=O)n(-c2cc(C(=O)OCc3ccccc3)c(Cl)cc2F)c(=O)n1C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.40
PKM P14618 1/20 0.40
GPBAR1 Q8TDU6 2/20 0.38
POLB P06746 1/20 0.38
KMT2A Q03164 2/20 0.38
ALDH1A1 P00352 2/20 0.38
CYP1A2 P05177 1/20 0.38
MAPT P10636 1/20 0.38
CYP2C9 P11712 1/20 0.38
MEN1 O00255 1/20 0.37
TP53 P04637 1/20 0.37
TDP1 Q9NUW8 2/20 0.37
STAT3 P40763 1/20 0.37
TSHR P16473 3/20 0.37
MAPK1 P28482 2/20 0.37
DHODH Q02127 2/20 0.36
LMNA P02545 1/20 0.36
CYP3A4 P08684 1/20 0.36
BAZ2B Q9UIF8 1/20 0.36
BAZ2A Q9UIF9 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
SCHEMBL9520994 0.88 L3MBTL1 (0.38) L3MBTL1PKMGPBAR1POLBKMT2A
SCHEMBL24151458 0.86 L3MBTL1 (0.41) L3MBTL1PKMGPBAR1POLBKMT2A
SCHEMBL22745804 0.82 MAPT (0.36) KMT2AALDH1A1CYP1A2MAPTCYP2C9
SCHEMBL9521057 0.81 GAA (0.38) CYP1A2MAPTCYP2C9TP53LMNA
SCHEMBL9350427 0.81 NOTUM (0.40) L3MBTL1PKMPOLBKMT2AALDH1A1
SCHEMBL9468954 0.79 MAPT (0.35) PKMPOLBKMT2AALDH1A1CYP1A2
SCHEMBL7547124 0.79 CYP1A2 (0.33) POLBKMT2ACYP1A2MAPTCYP2C9
SCHEMBL9567022 0.79 TSHR (0.35) L3MBTL1POLBKMT2AALDH1A1CYP1A2
SCHEMBL9499007 0.78 CYP1A2 (0.35) KMT2ACYP1A2MAPTCYP2C9TSHR
SCHEMBL9423183 0.78 ALDH1A1 (0.36) L3MBTL1KMT2AALDH1A1CYP1A2MAPT

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-0323487-B1 HETEROCYCLIC COMPOUNDS CIBA-GEIGY AG (CH) 1993-03-31 EP claimed