SCHEMBL11575252

SCHEMBL11575252

C/C(Cl)=C/CCC(=O)CCCl

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.42
FNTA P49354 1/20 0.38
FNTB P49356 1/20 0.38
KDM4E B2RXH2 1/20 0.32
ATM Q13315 1/20 0.32
POLB P06746 1/20 0.31

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
SCHEMBL11573227 1.00 ALDH1A1 (0.42) ALDH1A1FNTAFNTBKDM4EATM
SCHEMBL11438975 0.77 FNTA (0.41) ALDH1A1FNTAFNTBKDM4EATM
SCHEMBL11760473 0.77 FNTA (0.41) ALDH1A1FNTAFNTBKDM4EATM
SCHEMBL11095819 0.75
SCHEMBL10966032 0.75
SCHEMBL10966029 0.75
SCHEMBL8147441 0.73
SCHEMBL8147444 0.73
SCHEMBL11679238 0.73
SCHEMBL1685816 0.72

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
US-4108871-A Novel benzopyran derivatives SCHERING AKTIENGESELLSCHAFT (DE) 1978-08-22 US disclosed
US-4032540-A BENZOPYRAN DERIVATIVES SCHERING AKTIENGESELLSCHAFT (DT) 1977-06-28 US disclosed
US-3962280-A PROCESS FOR PREPARING BENZOPYRAN DERIVATIVES SCHERING AKTIENGESELLSCHAFT (DT) 1976-06-08 US disclosed