SCHEMBL11420525

SCHEMBL11420525

Cc1ccc(Oc2ccc(C(F)(F)F)cc2)cn1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ SCN8A Q9UQD0 1/20 0.45
▸ SCN10A Q9Y5Y9 1/20 0.45
▸ LTA4H P09960 2/20 0.42
▸ TTBK1 Q5TCY1 1/20 0.42
▸ SCN9A Q15858 3/20 0.41
▸ KCNH2 Q12809 2/20 0.41
▸ SCN5A Q14524 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ LIPE Q05469 1/20 0.40
▸ NPBWR1 P48145 1/20 0.39
▸ MCHR1 Q99705 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ MAP4K4 O95819 1/20 0.38
▸ CDK8 P49336 1/20 0.38

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
SCHEMBL11423141 0.82 CDK8 (0.50) LTA4HTTBK1SCN9AMAPTCDK8
SCHEMBL751951 0.79 MEN1 (0.44) MAP4K4
SCHEMBL20176873 0.79 TGFBR1 (0.46) LTA4HSCN9ALMNAMAP4K4
SCHEMBL8737063 0.79 TEAD4 (0.50) MAPTNPSR1MAP4K4
SCHEMBL16539484 0.79 GRM4 (0.55) LTA4HTTBK1SCN9AKCNH2SCN5A
SCHEMBL27428 0.78 KMT2A (0.47) MAPTNPSR1
SCHEMBL29497438 0.78 KMT2A (0.47) MAPTNPSR1
SCHEMBL11148692 0.78 CA1 (0.52) LTA4HSCN9AKCNH2SCN5AMAPT
SCHEMBL1685383 0.78 CA1 (0.52) LTA4HSCN9AKCNH2SCN5AMAPT
SCHEMBL509776 0.77 LTA4H (0.50) LTA4HLMNA

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-4229448-A 5-Substituted picolinic acid derivatives and an anti-hypertensive composition containing the same MEUJI SEIKA KAISHA LTD. (JP) 1980-10-21 — — US disclosed
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