SCHEMBL9360958

SCHEMBL9360958

CCC(C(=O)O)N(C(=O)Cc1ccccc1C)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CTBP2 P56545 1/20 0.42
POLQ O75417 1/20 0.41
ALDH1A1 P00352 3/20 0.40
TP53 P04637 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
LMNA P02545 1/20 0.40
HPGD P15428 1/20 0.39
SHBG P04278 1/20 0.38
PPARG P37231 2/20 0.38
TRPM8 Q7Z2W7 1/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
MAPT P10636 1/20 0.36
PPARA Q07869 1/20 0.36
FFAR1 O14842 1/20 0.35
GLA P06280 1/20 0.35
TSHR P16473 1/20 0.35

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
SCHEMBL9357340 0.91 CTBP2 (0.38) CTBP2POLQALDH1A1SMN1; SMN2HPGD
SCHEMBL9357397 0.85 POLQ (0.47) POLQALDH1A1SMN1; SMN2HPGDMEN1
SCHEMBL9360988 0.81 LMNA (0.41) POLQALDH1A1SMN1; SMN2LMNAMEN1
SCHEMBL9357000 0.78 ALDH1A1 (0.42) POLQALDH1A1TRPM8MEN1KMT2A
SCHEMBL28970987 0.78 ALDH1A1 (0.66) ALDH1A1TP53SMN1; SMN2LMNAMEN1
SCHEMBL9360756 0.77 TDP1 (0.48) ALDH1A1TP53SMN1; SMN2LMNAMEN1
SCHEMBL20166110 0.77 ALDH1A1 (0.49) ALDH1A1TP53SMN1; SMN2LMNAHPGD
SCHEMBL6136294 0.76 ALDH1A1 (0.45) ALDH1A1TP53SMN1; SMN2LMNAMEN1
SCHEMBL9360739 0.75 NPY5R (0.50) SMN1; SMN2PPARGPPARAFFAR1
SCHEMBL9222220 0.73 CES2 (0.48) ALDH1A1TP53SMN1; SMN2LMNAMEN1

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