SCHEMBL12802414

SCHEMBL12802414

C=CCCc1cc(C)c(C)c(C)c1

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ RAPGEF4 Q8WZA2 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ CRHR1 P34998 1/20 0.31
▸ FFAR4 Q5NUL3 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ PTGS1 P23219 1/20 0.31
▸ PTGS2 P35354 1/20 0.31

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
SCHEMBL12802125 0.87 TSHR (0.36) GAATSHR
SCHEMBL24595109 0.86 PTGS1 (0.33) PTGS1PTGS2
SCHEMBL15609627 0.79 RAPGEF4 (0.33) RAPGEF4FFAR4PTGS1PTGS2
SCHEMBL12802106 0.79 KMT2A (0.33) TSHR
SCHEMBL12802112 0.78 MAPT (0.36) PTGS1PTGS2
SCHEMBL21728101 0.78 — —
SCHEMBL14328220 0.78 — —
SCHEMBL1610947 0.77 RAPGEF4 (0.32) RAPGEF4PTGS1PTGS2
SCHEMBL16105713 0.77 RAPGEF4 (0.43) RAPGEF4FFAR4PTGS1PTGS2
SCHEMBL12802286 0.77 GAA (0.36) GAACRHR1

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-9587042-B2 Process for producing modified conjugated diene-based polymer, modified conjugated diene-based polymer, and polymer composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-03-07 — — US disclosed
US-8933165-B2 Method for producing modified conjugated diene-based polymer, and method for producing polymer composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-01-13 — — US disclosed
US-8835564-B2 Method for producing modified conjugated diene-based polymer, and method for producing polymer composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-09-16 — — US disclosed
US-20140088242-A1 METHOD FOR PRODUCING MODIFIED CONJUGATED DIENE-BASED POLYMER, AND METHOD FOR PRODUCING POLYMER COMPOSITION ZEON CORPORATION (JP) 2014-03-27 — — US disclosed
US-20140088256-A1 METHOD FOR PRODUCING MODIFIED CONJUGATED DIENE-BASED POLYMER, AND METHOD FOR PRODUCING POLYMER COMPOSITION ZEON CORPORATION (JP) 2014-03-27 — — US disclosed
US-20120252966-A1 PROCESS FOR PRODUCING MODIFIED CONJUGATED DIENE-BASED POLYMER, MODIFIED CONJUGATED DIENE-BASED POLYMER, AND POLYMER COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED 2012-10-04 — — US disclosed
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