SCHEMBL11297385

SCHEMBL11297385

CCCCCCCCc1ccc(NC(C)=O)cc1

nearest known ligand 0.68

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
THRA P10827 3/20 0.68
THRB P10828 3/20 0.68
POLB P06746 1/20 0.64
SPHK1 Q9NYA1 11/20 0.62
CA12 O43570 1/20 0.61
CA1 P00915 1/20 0.61
CA2 P00918 1/20 0.61
CA9 Q16790 1/20 0.61
S1PR1 P21453 1/20 0.61
SPHK2 Q9NRA0 1/20 0.59

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
SCHEMBL3027338 1.00 THRA (0.68) THRATHRBPOLBSPHK1CA12
SCHEMBL6746649 1.00 THRA (0.68) THRATHRBPOLBSPHK1CA12
SCHEMBL5546226 0.98 POLB (0.66) THRATHRBPOLBSPHK1CA12
SCHEMBL2748237 0.93 POLB (0.73) THRATHRBPOLBCA12CA1
SCHEMBL18405997 0.91 THRA (0.58) THRATHRBPOLBSPHK1CA12
SCHEMBL18405956 0.91 THRA (0.58) THRATHRBPOLBSPHK1CA12
SCHEMBL11116153 0.91 SMN1; SMN2 (0.59) THRATHRBPOLBCA12CA1
SCHEMBL18754283 0.89 POLB (0.56) THRATHRBPOLBSPHK1CA12
SCHEMBL10306586 0.89 MAPT (0.58) THRATHRBPOLBSPHK1CA12
SCHEMBL12125126 0.89 MAPT (0.58) THRATHRBPOLBSPHK1CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0010231-B1 POLYPHOSPHAZENE POLYMERS CONTAINING N-SUBSTITUTED AMIDO AND IMIDO SUBSTITUENTS AND PROCESS FOR THEIR PREPARATION THE FIRESTONE TIRE & RUBBER COMPANY (US) 1982-12-15 EP disclosed
US-4218557-A PROTECTIVE COATINGS, MOLDINGS, FOAMS THE FIRESTONE TIRE & RUBBER COMPANY (US) 1980-08-19 US disclosed
EP-0010231-A1 Polyphosphazene polymers containing N-substituted amido and imido substituents and process for their preparation THE FIRESTONE TIRE & RUBBER COMPANY (US) 1980-04-30 EP disclosed