SCHEMBL11737458

SCHEMBL11737458

CC(=CCCC(C)CCO)CC(C)C

nearest known ligand 0.64

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 2/20 0.64
ALDH1A1 P00352 2/20 0.64
PTPN1 P18031 1/20 0.38
TDP1 Q9NUW8 2/20 0.34
SQLE Q14534 1/20 0.31
USP2 O75604 1/20 0.31
KDM1A O60341 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
SCHEMBL11737454 1.00 ALOX15 (0.64) ALOX15ALDH1A1PTPN1TDP1SQLE
SCHEMBL15571282 0.83 ALOX15 (0.69) ALOX15ALDH1A1PTPN1TDP1SQLE
SCHEMBL15571280 0.83 ALOX15 (0.69) ALOX15ALDH1A1PTPN1TDP1SQLE
SCHEMBL28189394 0.83 ALOX15 (0.69) ALOX15ALDH1A1PTPN1TDP1SQLE
SCHEMBL23882535 0.82 ALOX15 (0.67) ALOX15ALDH1A1PTPN1TDP1SQLE
SCHEMBL23882536 0.82 ALOX15 (0.67) ALOX15ALDH1A1PTPN1TDP1SQLE
SCHEMBL23882538 0.82 ALOX15 (0.67) ALOX15ALDH1A1PTPN1TDP1SQLE
SCHEMBL23882548 0.82 ALOX15 (0.67) ALOX15ALDH1A1PTPN1TDP1SQLE
SCHEMBL23882546 0.82 ALOX15 (0.67) ALOX15ALDH1A1PTPN1TDP1SQLE
SCHEMBL3340108 0.82 ALOX15 (0.67) ALOX15ALDH1A1PTPN1TDP1SQLE

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-4011335-A INSECTICIDES, HORMONE INHIBITORS HOFFMANN-LA ROCHE INC. (US) 1977-03-08 US disclosed