SCHEMBL11459979

SCHEMBL11459979

CC#CCC(C)[C@H](O)C=C[C@H]1CCC(=O)[C@@H]1CCCCCCC(=O)NC(C)=O

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PTGER4 P35408 15/20 0.42
▸ MEN1 O00255 1/20 0.40
▸ GALR3 O60755 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ PTGER2 P43116 12/20 0.39
▸ PTGER3 P43115 10/20 0.39
▸ KCNH2 Q12809 2/20 0.39
▸ PTGIR P43119 2/20 0.36
▸ PTGER1 P34995 1/20 0.36
▸ PTGDR Q13258 1/20 0.36
▸ TBXA2R P21731 5/20 0.33

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
SCHEMBL11459978 1.00 PTGER4 (0.42) PTGER4MEN1GALR3KMT2APTGER2
SCHEMBL11449313 0.88 PTGER4 (0.53) PTGER4MEN1GALR3KMT2APTGER2
SCHEMBL11449312 0.88 PTGER4 (0.53) PTGER4MEN1GALR3KMT2APTGER2
SCHEMBL11469148 0.87 PTGER2 (0.38) PTGER4MEN1KMT2APTGER2PTGER3
SCHEMBL11469149 0.87 PTGER2 (0.38) PTGER4MEN1KMT2APTGER2PTGER3
SCHEMBL11459381 0.83 MEN1 (0.39) PTGER4MEN1GALR3KMT2APTGER2
SCHEMBL11459382 0.83 MEN1 (0.39) PTGER4MEN1GALR3KMT2APTGER2
Methanesulfonamide SCHEMBL11458408 0.83 PTGER4 (0.49) PTGER4MEN1GALR3KMT2APTGER2
SCHEMBL11482688 0.76 PTGIR (0.38) PTGER4PTGER2PTGER3KCNH2PTGIR
SCHEMBL11449056 0.74 PTGER2 (0.48) PTGER4MEN1KMT2APTGER2PTGER3

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-4235930-A INDUCTION OF MENSTRUATION OR ABORTION SCHERING, A.G. (DE) 1980-11-25 — — US disclosed
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