SCHEMBL21985363

SCHEMBL21985363

CCSc1cc(C(F)(F)F)cnc1-c1cn2cnc(C(F)(F)F)cc2n1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.33
PKM P14618 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 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
SCHEMBL20829808 0.89 UGCG (0.30)
SCHEMBL21727256 0.89 KDM4E (0.33) NPC1PKMRAB9ASMN1; SMN2
SCHEMBL24261720 0.88 ALDH1A1 (0.31)
SCHEMBL21727281 0.86
SCHEMBL24261739 0.86 SUV39H2 (0.31)
SCHEMBL24261721 0.85
SCHEMBL21727269 0.85 GRIN2B (0.32)
SCHEMBL17742116 0.85 PLK4 (0.40) NPC1PKMRAB9ASMN1; SMN2
SCHEMBL24261762 0.85
SCHEMBL21727295 0.85 TRPA1 (0.31) NPC1PKMRAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3778598-A2 PESTICIDALLY ACTIVE BI- OR TRICYCLIC HETEROCYCLES WITH SULFUR CONTAINING SUBSTITUENTS SYNGENTA PARTICIPATIONS AG (CH) 2021-02-17 EP disclosed
EP-3778599-A2 PESTICIDALLY ACTIVE BI- OR TRICYCLIC HETEROCYCLES WITH SULFUR CONTAINING SUBSTITUENTS SYNGENTA PARTICIPATIONS AG (CH) 2021-02-17 EP disclosed
EP-3016949-B1 PESTICIDALLY ACTIVE BI- OR TRICYCLIC HETEROCYCLES WITH SULFUR CONTAINING SUBSTITUENTS SYNGENTA PARTICIPATIONS AG (CH) 2020-05-13 EP disclosed