SCHEMBL8906385

SCHEMBL8906385

COCCCOc1cc(CC(CBr)C(C)C)ccc1C(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
REN P00797 19/20 0.41
LMNA P02545 1/20 0.40
MAPK1 P28482 1/20 0.40
HTT P42858 1/20 0.40

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
SCHEMBL8906390 1.00 REN (0.41) RENLMNAMAPK1HTT
SCHEMBL4300111 0.84 REN (0.52) REN
SCHEMBL4300113 0.84 REN (0.52) REN
SCHEMBL8904414 0.81 REN (0.43) REN
SCHEMBL8904417 0.81 REN (0.43) REN
SCHEMBL8906253 0.78 REN (0.46) REN
SCHEMBL8906257 0.78 REN (0.46) REN
SCHEMBL89109 0.77 HTT (0.45) RENLMNAMAPK1HTT
SCHEMBL6044305 0.75 REN (0.64) REN
SCHEMBL8904760 0.74 REN (0.45) REN

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
US-5659065-A CHEMICAL INTERMEDIATES FOR MEDICINAL ACTIVE AGENTS NOVARTIS CORPORATION (US) 1997-08-19 US disclosed
EP-0678500-A1 Alpha-amino alkanoic acids and reduction products as intermediates in the preparation of renin inhibitors CIBA-GEIGY AG (CH) 1995-10-25 EP disclosed