SCHEMBL9048247

SCHEMBL9048247

C[CH]CCCc1c(C)cccc1C(C)=O

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GPR52 Q9Y2T5 2/20 0.40
BRPF1 P55201 1/20 0.37
HPGD P15428 5/20 0.37
SMN1; SMN2 Q16637 4/20 0.37
MYC P01106 1/20 0.37
CXCR5 P32302 4/20 0.36
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
HSD17B10 Q99714 2/20 0.36
PPARG P37231 1/20 0.33
F2R P25116 1/20 0.33
LMNA P02545 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
SCHEMBL9044803 0.87 MYC (0.47) GPR52HPGDSMN1; SMN2MYCCXCR5
SCHEMBL9045101 0.84 KMT2A (0.39) GPR52SMN1; SMN2KDM4EALDH1A1LMNA
SCHEMBL9045394 0.84 AKR1B1 (0.39) HPGDSMN1; SMN2
SCHEMBL9045397 0.84 GABRA1 (0.35) GPR52KDM4EALDH1A1HSD17B10F2R
SCHEMBL9047469 0.83 CA2 (0.34) GPR52SMN1; SMN2ALDH1A1LMNA
SCHEMBL9057953 0.82 GABRA1 (0.41) HPGDSMN1; SMN2LMNA
SCHEMBL28638059 0.81 CXCR5 (0.47) BRPF1HPGDSMN1; SMN2CXCR5KDM4E
SCHEMBL9045526 0.80 BRPF1 (0.39) BRPF1HPGDSMN1; SMN2MYCCXCR5
SCHEMBL13148436 0.80 CXCR5 (0.50) BRPF1HPGDSMN1; SMN2MYCCXCR5
SCHEMBL17059414 0.78 TAAR1 (0.41) BRPF1HPGDSMN1; SMN2MYCCXCR5

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
EP-0690854-A1 1-PHENYL-IMIDAZOL-2-ONE BIPHENYLMETHYL COMPOUNDS FOR TREATMENT OF CIRCULATORY DISORDERS G.D. SEARLE & CO. (US) 1996-01-10 EP disclosed