SCHEMBL24286323

SCHEMBL24286323

CCSc1ccc(C2CC2)nc1-c1nc2cc(SC(F)(F)F)ncc2n1C

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CYP11B1 P15538 2/20 0.32
▸ CYP11B2 P19099 2/20 0.32
▸ ALOX5AP P20292 1/20 0.31

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
SCHEMBL17949566 0.87 CYP11B1 (0.32) CYP11B1CYP11B2ALOX5AP
SCHEMBL24286238 0.86 NPC1 (0.31) —
SCHEMBL17941539 0.84 CNR2 (0.33) CYP11B1CYP11B2ALOX5AP
SCHEMBL17941383 0.84 CYP11B1 (0.31) CYP11B1CYP11B2ALOX5AP
SCHEMBL29679728 0.84 CYP11B1 (0.31) CYP11B1CYP11B2ALOX5AP
SCHEMBL24286321 0.83 CYP11B1 (0.31) CYP11B1CYP11B2ALOX5AP
SCHEMBL17949563 0.78 PDE10A (0.34) —
SCHEMBL17901811 0.78 POLB (0.36) —
SCHEMBL20847450 0.78 — —
SCHEMBL22189258 0.78 — —

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
EP-3247712-B1 PESTICIDALLY ACTIVE POLYCYCLIC DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS SYNGENTA PARTICIPATIONS AG (CH) 2022-04-20 — — EP disclosed
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