SCHEMBL11834886

SCHEMBL11834886

Cc1[nH]c2cc(F)ccc2c1CCC(=O)N1CCN(c2ccc(F)cc2)CC1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ GFER P55789 1/20 0.54
▸ KMT2A Q03164 2/20 0.53
▸ LMNA P02545 1/20 0.53
▸ POLB P06746 2/20 0.52
▸ MAPT P10636 8/20 0.50
▸ MEN1 O00255 1/20 0.50
▸ PARP1 P09874 1/20 0.50
▸ PARP2 Q9UGN5 1/20 0.50
▸ GAA P10253 2/20 0.49
▸ TP53 P04637 2/20 0.49
▸ ALDH1A1 P00352 3/20 0.48
▸ HPGD P15428 2/20 0.48
▸ TSHR P16473 1/20 0.48
▸ NPSR1 Q6W5P4 1/20 0.48
▸ HSD17B10 Q99714 1/20 0.47
▸ TACR1 P25103 1/20 0.47

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
SCHEMBL11828042 0.94 GFER (0.55) GFERKMT2ALMNAMAPTMEN1
SCHEMBL11826994 0.85 TACR1 (0.61) GFERKMT2ALMNAPOLBMAPT
SCHEMBL11822960 0.83 TACR1 (0.69) KMT2ALMNAMEN1TACR1
SCHEMBL11823392 0.82 KMT2A (0.56) GFERKMT2ALMNAPOLBMAPT
SCHEMBL11834769 0.81 MEN1 (0.50) GFERKMT2APOLBMEN1GAA
SCHEMBL11825601 0.80 MAPT (0.64) KMT2ALMNAPOLBMAPTMEN1
SCHEMBL11828423 0.80 HTR1A (0.52) PARP1PARP2
SCHEMBL11821884 0.80 MAPT (0.65) KMT2ALMNAPOLBMAPTMEN1
SCHEMBL11829997 0.79 PKM (0.48) KMT2ALMNAPOLBMAPTGAA
SCHEMBL11830955 0.78 POLB (0.46) KMT2APOLBALDH1A1TSHRTACR1

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-3933824-A Piperazinobutyrophenone derivatives SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1976-01-20 — — US disclosed
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