SCHEMBL6770699

SCHEMBL6770699

CCCN(CCC)Cc1ccc(-c2ccc([C@@H](CCO)CCC(=O)NOC(C)(C)OC)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 4/20 0.40
RORC P51449 3/20 0.33
ALDH1A1 P00352 1/20 0.31
HTT P42858 1/20 0.31
PPARA Q07869 1/20 0.31
ACKR3 P25106 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
SCHEMBL6138439 0.84 HRH3 (0.40) HRH3RORCPPARA
SCHEMBL6138465 0.71 HDAC1 (0.35) HRH3
SCHEMBL6817795 0.68 HDAC2 (0.47)
SCHEMBL6817789 0.68 HDAC2 (0.47)
SCHEMBL6138877 0.65 HRH3 (0.49) HRH3RORC
SCHEMBL6138871 0.65 HRH3 (0.49) HRH3RORC
SCHEMBL6812985 0.64 HDAC2 (0.50)
SCHEMBL6812978 0.64 HDAC2 (0.50)
SCHEMBL6138387 0.63 MMP13 (0.36)
SCHEMBL19398654 0.62 HRH3 (0.43) HRH3RORCALDH1A1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6770644-B1 Hydroxamic acid derivatives, process for the production thereof and drug containing the same as the active ingredient ONO PHARMACEUTICALS CO., LTD. (JP) 2004-08-03 US disclosed