SCHEMBL4444938

SCHEMBL4444938

CCc1cccc(-c2ccc(C(N)=O)cc2)c1CC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 4/20 0.49
MKNK2 Q9HBH9 3/20 0.49
USP7 Q93009 1/20 0.48
FOLH1 Q04609 1/20 0.42
PARP10 Q53GL7 2/20 0.41
CREBBP Q92793 1/20 0.40
PLA2G10 O15496 1/20 0.39
PLA2G2A P14555 1/20 0.39
CHEK2 O96017 5/20 0.38
CCNC P24863 1/20 0.38
CDK8 P49336 1/20 0.38
CHEK1 O14757 2/20 0.38
POLB P06746 1/20 0.38
CYP3A4 P08684 1/20 0.38
PARP1 P09874 1/20 0.38
MAPT P10636 1/20 0.38
TSHR P16473 1/20 0.38
CYP2C19 P33261 1/20 0.38
RECQL P46063 1/20 0.38
BLM P54132 1/20 0.38

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
SCHEMBL6570559 0.85 FOLH1 (0.57) FOLH1HSD17B10
SCHEMBL4530811 0.85 MKNK1 (0.53) MKNK1MKNK2USP7PARP10PLA2G10
SCHEMBL4434804 0.84 BAZ2B (0.47) FOLH1CREBBPPARP1
SCHEMBL13821807 0.83 RAB9A (0.46) FOLH1MAPTTDP1L3MBTL1CA12
Bicarbonate SCHEMBL28365018 0.80 FOLH1 (0.50) FOLH1PLA2G2A
SCHEMBL27588092 0.79 PLA2G10 (0.43) PARP10PLA2G10PLA2G2APOLBCYP3A4
Acetic Acid SCHEMBL28455812 0.78 FOLH1 (0.49) FOLH1PLA2G2A
SCHEMBL473270 0.77 PDCD1 (0.50) FOLH1PLA2G2A
SCHEMBL27618792 0.75 PDCD1 (0.48) FOLH1PLA2G2A
SCHEMBL11382363 0.75 PDCD1 (0.48) FOLH1PLA2G2A

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-2121621-A1 LXR AND FXR MODULATORS Exelixis, Inc. (US) 2009-11-25 EP disclosed
WO-2008073825-A1 LXR AND FXR MODULATORS EXELIXIS, INC. (US) 2008-06-19 WO disclosed