SCHEMBL3357901

SCHEMBL3357901

C=Cc1ccc(CCN2CCC(C)CC2)cc1

nearest known ligand 0.69

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 3/20 0.69
ACHE P22303 2/20 0.64
SIGMAR1 Q99720 3/20 0.51
SPHK1 Q9NYA1 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
CCR3 P51677 1/20 0.43
KDM4E B2RXH2 1/20 0.43
HTR2A P28223 1/20 0.43
HTR2C P28335 1/20 0.43
HTR7 P34969 1/20 0.43

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
SCHEMBL610232 0.85 SIGMAR1 (0.52) HRH3SIGMAR1L3MBTL1
SCHEMBL14305457 0.84 HRH3 (0.67) HRH3ACHEHTR7
SCHEMBL3356655 0.82 HRH3 (0.47) HRH3ACHEL3MBTL1KDM4E
SCHEMBL6419877 0.82 HRH3 (0.75) HRH3ACHESIGMAR1SPHK1L3MBTL1
SCHEMBL613544 0.82 HRH3 (0.61) HRH3SIGMAR1L3MBTL1
SCHEMBL3359369 0.81 HRH3 (0.46) HRH3ACHESIGMAR1KDM4E
SCHEMBL3356095 0.81 L3MBTL3 (0.62) HRH3L3MBTL1
SCHEMBL23711032 0.80 HRH3 (0.77) HRH3ACHESIGMAR1SPHK1
SCHEMBL3357116 0.80 HRH3 (0.65) HRH3SIGMAR1L3MBTL1
SCHEMBL3356355 0.80 HRH3 (0.65) HRH3SIGMAR1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2177562-B1 Polymer, rubber composition and tire using the same SUMITOMO RUBBER IND (JP) 2014-05-14 EP disclosed
EP-2184318-B1 Rubber composition and tire SUMITOMO RUBBER IND (JP) 2014-03-19 EP disclosed
US-8431644-B2 Rubber composition and tire SUMITOMO RUBBER INDUSTRIES, LTD. (JP) 2013-04-30 US disclosed
EP-2182028-B1 Rubber composition and tire SUMITOMO RUBBER IND (JP) 2012-12-12 EP disclosed
EP-2184318-A2 Rubber composition and tire Sumitomo Rubber Industries, Ltd. (JP) 2010-05-12 EP disclosed
EP-2182028-A1 Rubber composition and tire Sumitomo Rubber Industries, Ltd. (JP) 2010-05-05 EP disclosed
US-20100105826-A1 RUBBER COMPOSITION AND TIRE SUMITOMO RUBBER INDUSTRIES, LTD. (JP) 2010-04-29 US disclosed
US-20100099810-A1 POLYMER, RUBBER COMPOSITION AND TIRE USING THE SAME SUMITOMO RUBBER INDUSTRIES, LTD. (JP) 2010-04-22 US disclosed
US-20100099795-A1 RUBBER COMPOSITION AND TIRE SUMITOMO RUBBER INDUSTRIES, LTD. (JP) 2010-04-22 US disclosed
EP-2177562-A2 Polymer, rubber composition and tire using the same Sumitomo Rubber Industries, Ltd. (JP) 2010-04-21 EP disclosed