SCHEMBL11241720

SCHEMBL11241720

CCC(Cl)c1cc(C)cs1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DAO P14920 1/20 0.32
CXCR1 P25024 1/20 0.30
CXCR2 P25025 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
SCHEMBL23241717 0.75 DAO (0.32) DAOCXCR1CXCR2
SCHEMBL12261613 0.75 DAO (0.32) DAOCXCR1CXCR2
SCHEMBL9918172 0.70
SCHEMBL8954534 0.69 KDM4E (0.40) DAOCXCR1CXCR2
SCHEMBL6696769 0.69 DAO (0.31) DAO
SCHEMBL27617816 0.68 DAO (0.42) DAO
SCHEMBL23241697 0.68 CA2 (0.37) DAO
SCHEMBL9403603 0.67
SCHEMBL12261614 0.65 DAO (0.34) DAO
SCHEMBL23241469 0.65 DAO (0.34) DAO

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-4316905-A HYPOTENSIVE AGENTS E. R. SQUIBB & SONS, INC. (US) 1982-02-23 US disclosed