SCHEMBL12802129

SCHEMBL12802129

C=CCCCc1cc(C)cc(C)c1C

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 1/20 0.36
TSHR P16473 2/20 0.32
ALDH1A1 P00352 1/20 0.32
KMT2A Q03164 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
GAA P10253 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
SCHEMBL12802286 0.89 GAA (0.36) KMT2ASMN1; SMN2GAA
SCHEMBL1611021 0.81 KMT2A (0.30) KMT2A
SCHEMBL12802111 0.80 HRH3 (0.41) TLR8TSHRALDH1A1KMT2ASMN1; SMN2
SCHEMBL12802125 0.79 TSHR (0.36) TLR8TSHRALDH1A1GAA
SCHEMBL1610692 0.79 TAAR1 (0.31)
SCHEMBL12802432 0.78 TLR8 (0.40) TLR8ALDH1A1KMT2ASMN1; SMN2GAA
SCHEMBL12802144 0.78 TAAR1 (0.53) TLR8TSHRALDH1A1KMT2AGAA
SCHEMBL1610234 0.77 TAAR1 (0.31)
SCHEMBL1611655 0.76 KMT2A (0.33) KMT2A
SCHEMBL18602124 0.76 HTT (0.41) TLR8ALDH1A1KMT2ASMN1; SMN2

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