SCHEMBL1624072

SCHEMBL1624072

COc1ccccc1CCC=C(C)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 1/20 0.54
MTNR1B P49286 1/20 0.54
TAAR1 Q96RJ0 3/20 0.47
KDM4E B2RXH2 3/20 0.46
ALDH1A1 P00352 2/20 0.46
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
CHRM2 P08172 1/20 0.46
CHRM1 P11229 1/20 0.46
CHRM3 P20309 1/20 0.46
IDO1 P14902 1/20 0.44

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
SCHEMBL13286297 0.82 TAAR1 (0.55) MTNR1AMTNR1BTAAR1CHRM2CHRM1
SCHEMBL678767 0.80 CTBP2 (0.45) TAAR1KDM4EALDH1A1KMT2A
SCHEMBL1060627 0.80 AKR1B1 (0.47) TAAR1IDO1
SCHEMBL1137147 0.80 AKR1B1 (0.47) TAAR1IDO1
SCHEMBL12003261 0.80 CTBP2 (0.45) TAAR1KDM4EALDH1A1KMT2A
SCHEMBL19656187 0.80 GPR52 (0.55) TAAR1ALDH1A1KMT2AMEN1IDO1
SCHEMBL1920921 0.78 CTBP2 (0.44) TAAR1SMN1; SMN2CHRM2CHRM1CHRM3
SCHEMBL440569 0.78 CTBP2 (0.44) TAAR1SMN1; SMN2CHRM2CHRM1CHRM3
SCHEMBL22129607 0.77 HRH1 (0.48)
SCHEMBL22129634 0.76 HRH1 (0.47)

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8936854-B2 Method of forming antifouling coating film NIPPON PAINT MARINE COATINGS CO., LTD. (JP) 2015-01-20 US disclosed
US-8597795-B2 Antifouling coating composition, antifouling film, composite film, and in-water structure NIPPON PAINT MARINE COATINGS CO., LTD. (JP) 2013-12-03 US disclosed
US-20120294825-A1 METHOD OF FORMING ANTIFOULING COATING FILM NIPPON PAINT MARINE COATINGS CO., LTD. (JP) 2012-11-22 US disclosed
US-7928175-B2 Antifouling paint composition MITSUBISHI RAYON CO., LTD. (JP) 2011-04-19 US disclosed
US-20060258772-A1 Antifouling paint composition MITSUBISHI RAYON CO. LTD. (JP) 2006-11-16 US disclosed
US-20050065232-A1 Antifouling paint composition, antifouling paint films, and, ships, underwater underwater structures, fishing gear and fishing nets covered with the films CHUGOKU MARINE PAINTS, LTD. (JP) 2005-03-24 US disclosed