SCHEMBL9309239

SCHEMBL9309239

O=C1CC[C@H](c2ccccc2)[C@@H](c2ccccc2)N1CO

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TP53 P04637 9/20 0.53
MDM2 Q00987 9/20 0.53
KMT2A Q03164 4/20 0.48
MEN1 O00255 3/20 0.48
POLB P06746 1/20 0.48
HTT P42858 1/20 0.42
CHRM2 P08172 1/20 0.41
CHRM4 P08173 1/20 0.41
CHRM5 P08912 1/20 0.41
CHRM1 P11229 1/20 0.41
CHRM3 P20309 1/20 0.41
SIGMAR1 Q99720 1/20 0.40
SRD5A1 P18405 1/20 0.40
LMNA P02545 1/20 0.37
P2RX7 Q99572 1/20 0.36
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL9309243 1.00 TP53 (0.53) TP53MDM2KMT2AMEN1POLB
SCHEMBL9309234 1.00 TP53 (0.53) TP53MDM2KMT2AMEN1POLB
SCHEMBL9283240 0.84 TP53 (0.53) TP53MDM2KMT2AMEN1POLB
SCHEMBL9283243 0.84 TP53 (0.53) TP53MDM2KMT2AMEN1POLB
SCHEMBL9283247 0.84 TP53 (0.53) TP53MDM2KMT2AMEN1POLB
SCHEMBL24508712 0.70 CHRM2 (0.55) KMT2AMEN1POLBCHRM2CHRM4
SCHEMBL21104990 0.69 KMT2A (0.51) TP53MDM2KMT2AMEN1POLB
SCHEMBL21056614 0.69 KMT2A (0.76) KMT2AMEN1POLBHTTSRD5A1
SCHEMBL19750826 0.68 SIGMAR1 (0.45) TP53MDM2KMT2AMEN1POLB
SCHEMBL10687774 0.68 KMT2A (0.67) TP53MDM2KMT2AMEN1POLB

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-5334720-A Diphenyl-1-(aminoalkyl)-2-piperidinone and -2-pyrrolidinone derivatives having anticonvulsant properties FISONS CORPORATION (US) 1994-08-02 US disclosed