SCHEMBL30490811

SCHEMBL30490811

CCSc1cc(Br)ccc1-c1nc2cc(C(F)(F)F)nnc2n1C

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PDE2A O00408 2/20 0.32
▸ NT5E P21589 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ ALDH1A1 P00352 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
SCHEMBL20482313 1.00 PDE2A (0.32) PDE2ANT5EMAPTALDH1A1
SCHEMBL17466030 0.89 NPC1 (0.32) MAPTALDH1A1
SCHEMBL16064947 0.88 DDR1 (0.34) PDE2A
SCHEMBL25239673 0.87 PDE2A (0.38) PDE2AALDH1A1
SCHEMBL30436669 0.87 PDE2A (0.38) PDE2AALDH1A1
SCHEMBL17666805 0.86 PDE2A (0.34) PDE2ANT5EALDH1A1
SCHEMBL17696192 0.85 POLB (0.33) PDE2AALDH1A1
SCHEMBL29482593 0.83 — —
SCHEMBL24313972 0.83 — —
SCHEMBL19268282 0.83 POLB (0.31) —

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
CN-116804010-A Pesticidally active heterocyclic derivatives with sulfur containing substituents 先正达参股股份有限公司 2023-09-26 — — CN disclosed
CN-110312707-B Pesticidally active heterocyclic derivatives with sulfur containing substituents 先正达参股股份有限公司 2023-06-23 — — CN disclosed
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