SCHEMBL11391004

SCHEMBL11391004

CCCCC(C)(C)C(O)/C=C/C[C@H](C)CCCC(C)(C)O

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PTGER1 P34995 2/20 0.33
▸ PTGER3 P43115 2/20 0.33
▸ TBXA2R P21731 1/20 0.33
▸ PTGFR P43088 1/20 0.33
▸ PTGER4 P35408 1/20 0.32
▸ PTGER2 P43116 1/20 0.32
▸ MEN1 O00255 1/20 0.30
▸ CYP3A4 P08684 1/20 0.30
▸ ALOX15 P16050 1/20 0.30
▸ KMT2A Q03164 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
SCHEMBL11402446 0.81 MAPT (0.42) —
SCHEMBL11394701 0.81 MAPT (0.42) —
SCHEMBL11402433 0.81 MAPT (0.42) —
SCHEMBL11397306 0.72 ALDH1A1 (0.39) CYP3A4
SCHEMBL24652499 0.72 TBXA2R (0.36) PTGER1PTGER3TBXA2RPTGFRPTGER4
SCHEMBL26317183 0.72 TBXA2R (0.36) PTGER1PTGER3TBXA2RPTGFRPTGER4
SCHEMBL26317166 0.72 TBXA2R (0.36) PTGER1PTGER3TBXA2RPTGFRPTGER4
SCHEMBL12844291 0.71 MEN1 (0.42) MEN1CYP3A4ALOX15KMT2A
SCHEMBL14137768 0.70 PTGER3 (0.37) PTGER1PTGER3TBXA2RPTGFRPTGER4
SCHEMBL11388461 0.70 PPARG (0.43) MEN1CYP3A4KMT2A

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-4243683-A INSECTICIDES, MITICIDES MAY & BAKER LIMITED (GB) 1981-01-06 — — US disclosed
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