SCHEMBL7696576

SCHEMBL7696576

Cc1ccc(C(=O)CC(=O)Nc2ccccc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 8/20 0.68
RAB9A P51151 7/20 0.68
MEN1 O00255 7/20 0.68
NPC1 O15118 5/20 0.68
POLB P06746 3/20 0.61
ALDH1A1 P00352 2/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
SMN1; SMN2 Q16637 2/20 0.55
CYP1A2 P05177 1/20 0.55
CYP3A4 P08684 1/20 0.55
CYP2C9 P11712 1/20 0.55
CYP2C19 P33261 1/20 0.55
MAPT P10636 2/20 0.54
TDP1 Q9NUW8 1/20 0.54
ATM Q13315 1/20 0.54

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
SCHEMBL6537209 0.93 RAB9A (0.71) KMT2ARAB9AMEN1NPC1POLB
SCHEMBL20851771 0.91 POLB (0.74) KMT2ARAB9AMEN1NPC1POLB
SCHEMBL11572863 0.91 RAB9A (0.71) KMT2ARAB9AMEN1NPC1ALDH1A1
SCHEMBL1098345 0.87 RAB9A (0.77) KMT2ARAB9AMEN1NPC1POLB
SCHEMBL14890950 0.85 RAB9A (0.74) KMT2ARAB9AMEN1NPC1POLB
SCHEMBL3317511 0.85 CA12 (0.62) KMT2AMEN1POLBALDH1A1SMN1; SMN2
SCHEMBL9508626 0.84 KMT2A (0.63) KMT2ARAB9AMEN1NPC1POLB
SCHEMBL11795069 0.84 RAB9A (0.68) KMT2ARAB9AMEN1NPC1ALDH1A1
SCHEMBL11782142 0.83 KMT2A (0.83) KMT2ARAB9AMEN1NPC1POLB
SCHEMBL8987179 0.83 POLB (0.58) KMT2ARAB9AMEN1NPC1POLB

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2002066443-A2 2-THIOXO-1,2,3,4-TETRAHYDROPYRIMIDINE DERIVATIVES ONO PHARMACEUTICAL CO., LTD. (JP) 2002-08-29 WO disclosed
US-5492915-A ANTIINFLAMMATORY AGENTS RHONE-POULENC RORER S.A. (FR) 1996-02-20 US disclosed
US-5366982-A Antiinflammatory agents or antihistamines RHONE-POULENC RORER S.A. (FR) 1994-11-22 US disclosed
EP-0540604-A1 SUBSTITUTED BICYCLIC BIS-ARYL COMPOUNDS EXHIBITING SELECTIVE LEUKOTRIENE B 4? ANTAGONIST ACTIVITY, THEIR PREPARATION AND USE IN PHARMACEUTICAL COMPOSITIONS Aventis Pharma S.A. (FR) 1993-05-12 EP disclosed
WO-1992001675-A2 SUBSTITUTED BICYCLIC BIS-ARYL COMPOUNDS EXHIBITING SELECTIVE LEUKOTRIENE B4 ANTAGONIST ACTIVITY, THEIR PREPARATION AND USE IN PHARMACEUTICAL COMPOSITIONS RHONE-POULENC RORER S.A. (FR) 1992-02-06 WO disclosed