SCHEMBL9357397

SCHEMBL9357397

CCC(C(=O)O)N(C(=O)Cc1ccccc1C)c1cccc(C(F)(F)F)c1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLQ O75417 8/20 0.47
HPGD P15428 1/20 0.41
HTT P42858 1/20 0.41
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
GAA P10253 1/20 0.39
CYP1A2 P05177 2/20 0.39
CYP3A4 P08684 2/20 0.39
ALDH1A1 P00352 1/20 0.39
POLB P06746 1/20 0.39
CYP2C9 P11712 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
LTB4R2 Q9NPC1 2/20 0.39
MAPT P10636 1/20 0.38
TACR1 P25103 1/20 0.38
CYP2C19 P33261 1/20 0.37

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
SCHEMBL9356735 0.89 POLQ (0.47) POLQHPGDHTTMEN1KMT2A
SCHEMBL9360958 0.85 CTBP2 (0.42) POLQHPGDMEN1KMT2AALDH1A1
SCHEMBL9356980 0.85 POLQ (0.43) POLQHPGDHTTMEN1KMT2A
SCHEMBL9356987 0.81 CETP (0.49) POLQHTTMEN1KMT2AALDH1A1
SCHEMBL6136371 0.81 MEN1 (0.43) POLQHPGDHTTMEN1KMT2A
SCHEMBL9357340 0.80 CTBP2 (0.38) POLQHPGDCYP3A4ALDH1A1CYP2C9
SCHEMBL9356743 0.80 PPARG (0.45) MEN1KMT2AALDH1A1
SCHEMBL9357323 0.79 OPRK1 (0.46) HTTMEN1KMT2AGAACYP1A2
SCHEMBL9360721 0.77 OPRK1 (0.44) MEN1KMT2ACYP1A2CYP3A4CYP2C9
SCHEMBL21518476 0.75 POLQ (0.45) POLQHPGDHTTMEN1KMT2A

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-0415185-B1 4-Alkoxy- and 4-(substituted)amino-3-arylpyrrolinones derivatives BAYER AG (DE) 1994-12-07 EP disclosed
EP-0415185-A1 4-Alkoxy- and 4-(substituted)amino-3-arylpyrrolinones derivatives BAYER AG (DE) 1991-03-06 EP disclosed