SCHEMBL10955014

SCHEMBL10955014

Cc1ccc(C(=O)c2ccc(F)cc2)c2c1CC(=O)N2

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
CES2 O00748 1/20 0.36
CES1 P23141 1/20 0.36
LMNA P02545 5/20 0.35
ALDH1A1 P00352 4/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
TDP1 Q9NUW8 1/20 0.35
GRM5 P41594 1/20 0.35
F2 P00734 1/20 0.35
PLAU P00749 1/20 0.35
ELANE P08246 1/20 0.35
LTA4H P09960 1/20 0.34
NPC1 O15118 2/20 0.34
TP53 P04637 2/20 0.34
RAB9A P51151 2/20 0.34
MAPT P10636 4/20 0.33
MAPK14 Q16539 1/20 0.33
ALPG P10696 1/20 0.33
POLB P06746 1/20 0.33

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
SCHEMBL10953176 0.84 MEN1 (0.37) MEN1KMT2ACES2CES1LMNA
SCHEMBL10954935 0.77 LMNA (0.38) MEN1KMT2ALMNAALDH1A1SMN1; SMN2
SCHEMBL10951240 0.75 SMYD3 (0.50) LMNAALDH1A1SMN1; SMN2GRM5LTA4H
SCHEMBL10946376 0.75 LMNA (0.40) MEN1KMT2ALMNAALDH1A1SMN1; SMN2
SCHEMBL10952498 0.74 PKM (0.36) CES2CES1LMNAALDH1A1SMN1; SMN2
SCHEMBL22691798 0.73 DRD2 (0.37) MEN1KMT2ATP53RAB9AMAPT
SCHEMBL10949987 0.72 HDAC3 (0.39) MEN1KMT2ALMNAALDH1A1SMN1; SMN2
SCHEMBL7527765 0.72 DRD2 (0.38) MEN1KMT2ACES1RAB9AMAPT
SCHEMBL9909635 0.70 DRD2 (0.55) RAB9AMAPTNPSR1
SCHEMBL10947561 0.69 GRM5 (0.42) MEN1KMT2ALMNAALDH1A1SMN1; SMN2

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-4503073-A ANTIINFLAMMATORY, ANALGESIC, ANTICOAGULANT A. H. ROBINS COMPANY, INCORPORATED (US) 1985-03-05 US disclosed