SCHEMBL8996566

SCHEMBL8996566

CCCCCNc1ccc(O)cc1C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.49
▸ ALDH1A1 P00352 2/20 0.49
▸ GLA P06280 1/20 0.49
▸ THRB P10828 1/20 0.49
▸ HPGD P15428 1/20 0.49
▸ NAAA Q02083 1/20 0.48
▸ CYP3A4 P08684 2/20 0.47
▸ TSHR P16473 2/20 0.47
▸ RECQL P46063 1/20 0.47
▸ HCAR3 P49019 1/20 0.43
▸ GPR84 Q9NQS5 3/20 0.42
▸ AR P10275 1/20 0.42
▸ VDR P11473 1/20 0.42
▸ ALOX15 P16050 2/20 0.41
▸ TYR P14679 2/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ TP53 P04637 1/20 0.41
▸ ALOX5 P09917 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ KMT2A Q03164 1/20 0.41

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
SCHEMBL16900566 0.87 CYP3A4 (0.52) MAPTALDH1A1GLATHRBHPGD
SCHEMBL2398365 0.85 CYP3A4 (0.64) MAPTALDH1A1NAAACYP3A4TSHR
SCHEMBL10499439 0.83 CYP3A4 (0.41) MAPTALDH1A1GLATHRBHPGD
SCHEMBL11331958 0.82 SMN1; SMN2 (0.45) MAPTALDH1A1HCAR3MEN1HTT
SCHEMBL11329911 0.81 PLK1 (0.47) MAPTALDH1A1MEN1HTTKMT2A
SCHEMBL11329867 0.81 PLK1 (0.47) MAPTALDH1A1MEN1HTTKMT2A
SCHEMBL11338770 0.81 PLK1 (0.47) MAPTALDH1A1MEN1HTTKMT2A
SCHEMBL11337228 0.81 PLK1 (0.47) MAPTALDH1A1MEN1HTTKMT2A
SCHEMBL11331968 0.81 PLK1 (0.47) MAPTALDH1A1MEN1HTTKMT2A
SCHEMBL11335028 0.81 PLK1 (0.47) MAPTALDH1A1MEN1HTTKMT2A

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
JP-8092184-A — — None — — JP disclosed
JP-H0892184-A 4-ACYLAMIDO-3-METHYL-CYCLOHEXANONE AND PRODUCTION THEREOF MITSUI TOATSU CHEM INC 1996-04-09 — — JP disclosed
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