SCHEMBL27876017

SCHEMBL27876017

C=CC1(c2ccc(CN)cc2)C=CC=CC1

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.31
LOXL2 Q9Y4K0 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
SCHEMBL27875958 0.85 PNMT (0.33) LOXL2
SCHEMBL27875941 0.84
SCHEMBL28801247 0.80 THRB (0.39)
SCHEMBL5537290 0.79 ALDH1A1 (0.38)
SCHEMBL28655485 0.79
SCHEMBL28033234 0.79 ESR1 (0.33)
SCHEMBL22577725 0.78 HDAC4 (0.30)
Benzene SCHEMBL27774129 0.76 ALDH1A1 (0.36)
SCHEMBL16107321 0.74
SCHEMBL27892553 0.74 HCAR3 (0.32)

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
CN-102731722-B For the production of the method for modified conjugated diene polymer, modified conjugated diene polymer and polymer composition SUMITOMO CHEMICAL CO., LTD. (JP) 2016-03-16 CN disclosed
CN-102731722-A Process for producing modified conjugated diene-based polymer, modified conjugated diene-based polymer, and polymer composition SUMITOMO CHEMICAL CO 2012-10-17 CN disclosed