SCHEMBL9645955

SCHEMBL9645955

CC(C)(C)Cl.Cl[Ti](Cl)(Cl)Cl

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.50
THRB P10828 1/20 0.36
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
CYP2E1 P05181 1/20 0.30

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
SCHEMBL7490 0.82
SCHEMBL10649555 0.82
SCHEMBL28645784 0.76
Hydrochloric Acid SCHEMBL8051087 0.76
SCHEMBL17698517 0.76
SCHEMBL31367011 0.76
SCHEMBL116471 0.76
Ammonia Solution, Strong SCHEMBL662589 0.76
SCHEMBL5495232 0.76
SCHEMBL10416943 0.76

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
EP-0331312-B1 PROCESS FOR PREPARING ELASTOMERIC POLYARYLATE GRAFT COPOLYMERS AND POLYARYLATE BEARING ONE DIHYDROCYCLOBUTENE END GROUP AMOCO CORPORATION (US) 1992-11-11 EP disclosed
US-4937287-A Addition-condensation copolymers; oxidation and heat resistance, photostability AMOCO CORPORATION (US) 1990-06-26 US disclosed