SCHEMBL14424432

SCHEMBL14424432

C=CCCc1cc(C)c(I)c(F)c1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ PTGS1 P23219 1/20 0.32
▸ PTGS2 P35354 1/20 0.32

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
SCHEMBL3753516 0.87 — —
SCHEMBL24595109 0.82 PTGS1 (0.33) PTGS1PTGS2
SCHEMBL14424433 0.76 — —
SCHEMBL12802414 0.75 RAPGEF4 (0.32) PTGS1PTGS2
SCHEMBL12955393 0.75 DAO (0.45) PTGS1PTGS2
SCHEMBL21728216 0.75 DAO (0.45) PTGS1PTGS2
SCHEMBL13913195 0.71 — —
SCHEMBL13913193 0.71 — —
SCHEMBL14424431 0.71 — —
SCHEMBL14424435 0.69 NOS1 (0.33) PTGS1PTGS2

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-7255811-B2 Tolane derivatives and liquid crystalline medium MERCK PATENT GMBH (DE) 2007-08-14 — — US disclosed
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