SCHEMBL13639828

SCHEMBL13639828

Cc1ccccc1CCC(=O)C1CC1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.44
ALDH1A1 P00352 5/20 0.43
NOTUM Q6P988 1/20 0.43
HPGD P15428 4/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CTBP2 P56545 1/20 0.39
ACHE P22303 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
SSTR4 P31391 1/20 0.39
KDM4E B2RXH2 1/20 0.39
KMT2A Q03164 1/20 0.39
ABL1 P00519 1/20 0.38
RIN1 Q13671 1/20 0.38
PTGER1 P34995 1/20 0.38
PTGFR P43088 1/20 0.38

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
SCHEMBL22879433 0.79 HPGD (0.41) TAAR1ALDH1A1NOTUMHPGDCTBP2
SCHEMBL7331759 0.77 TAAR1 (0.54) TAAR1ALDH1A1NOTUMHPGDCTBP2
SCHEMBL11552340 0.77 ALDH1A1 (0.56) ALDH1A1HPGDSMN1; SMN2ACHEKDM4E
SCHEMBL8597351 0.77 IAPP (0.59) TAAR1ALDH1A1NOTUMHPGDSMN1; SMN2
SCHEMBL21505722 0.76 ALDH1A1 (0.66) ALDH1A1HPGDSMN1; SMN2KDM4EKMT2A
SCHEMBL1404957 0.76 IAPP (0.56) TAAR1ALDH1A1NOTUMHPGDCTBP2
SCHEMBL29843936 0.76 NPSR1 (0.61) TAAR1ALDH1A1NOTUMHPGDCTBP2
SCHEMBL6959430 0.76 TAAR1 (0.52) TAAR1ALDH1A1NOTUMHPGDCTBP2
SCHEMBL323867 0.76 NPSR1 (0.61) TAAR1ALDH1A1NOTUMHPGDCTBP2
SCHEMBL29843018 0.76 IAPP (0.56) TAAR1ALDH1A1NOTUMHPGDCTBP2

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-1445249-B1 NOVEL BENSOPHENONE DERIVATIVES OR SALTS THEREOF TOYAMA CHEMICAL CO LTD (JP) 2012-11-07 EP disclosed
EP-1939687-A2 Polymerizable composition, lithographic printing plate precursor and lithographic printing method FUJIFILM Corporation (JP) 2008-07-02 EP disclosed