SCHEMBL31309136

SCHEMBL31309136

COc1cc(C(F)(F)F)ccc1-c1nnc(Cl)c2ccncc12

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 16/20 0.46
PDE5A O76074 1/20 0.43
CYP3A4 P08684 1/20 0.41
ALOX5AP P20292 1/20 0.40
FEN1 P39748 1/20 0.40
CYP1A2 P05177 1/20 0.40
METAP2 P50579 1/20 0.40

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
SCHEMBL30181352 0.95 SCN9A (0.46) SCN9APDE5ACYP3A4ALOX5APFEN1
SCHEMBL27354580 0.95 SCN9A (0.46) SCN9APDE5ACYP3A4ALOX5APFEN1
SCHEMBL31309284 0.86 SCN9A (0.46) SCN9ACYP3A4ALOX5APFEN1CYP1A2
SCHEMBL31309258 0.85 PDE5A (0.46) SCN9APDE5AALOX5APFEN1
SCHEMBL24379596 0.84 SCN9A (0.40) SCN9APDE5A
SCHEMBL31309249 0.84 SCN9A (0.46) SCN9ACYP3A4ALOX5APFEN1CYP1A2
SCHEMBL30214805 0.84 SCN9A (0.39) SCN9APDE5ACYP3A4
SCHEMBL30214803 0.84 SCN9A (0.39) SCN9APDE5ACYP3A4
SCHEMBL30108760 0.83 MAOA (0.37) SCN9APDE5A
SCHEMBL27354709 0.82 CYP11B1 (0.48)

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4735433-A2 SUBSTITUTED PYRIDAZINE COMPOUNDS AS INHIBITORS OF NLRP3 ACTIVITY AND THERAPEUTIC USES THEREOF Viva Star Biosciences (US) Inc. (US) 2026-05-06 EP disclosed
WO-2025006681-A2 SUBSTITUTED PYRIDAZINE COMPOUNDS AS INHIBITORS OF NLRP3 ACTIVITY AND THERAPEUTIC USES THEREOF VIVA STAR BIOSCIENCES (US) INC. (US) 2025-01-02 WO disclosed