SCHEMBL28701113

SCHEMBL28701113

CCSc1nn2cc(-c3ccccc3)cnc2c1-c1nc2cc(C(F)(F)F)ncc2n1C

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 4/20 0.34
▸ DHODH Q02127 1/20 0.33
▸ LMNA P02545 2/20 0.32
▸ MAPT P10636 2/20 0.32
▸ SMN1; SMN2 Q16637 2/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ GRIN1 Q05586 1/20 0.30
▸ GRIN2B Q13224 1/20 0.30
▸ TLR7 Q9NYK1 1/20 0.30

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
SCHEMBL29525647 0.92 SMN1; SMN2 (0.39) LMNAMAPTSMN1; SMN2RAB9AKMT2A
SCHEMBL29525354 0.90 MAPT (0.34) LMNAMAPTSMN1; SMN2RAB9AKMT2A
SCHEMBL29525846 0.89 SCN5A (0.33) MAOB
SCHEMBL29525628 0.86 ATR (0.34) —
SCHEMBL28683302 0.85 MAPT (0.33) DHODHMAPTSMN1; SMN2ALDH1A1POLB
SCHEMBL22775940 0.84 POLB (0.42) MAOBLMNAMAPTSMN1; SMN2RAB9A
SCHEMBL28684959 0.84 PTGS2 (0.34) MAOBDHODHMAPTRAB9AKMT2A
SCHEMBL22776126 0.83 HTR6 (0.32) —
SCHEMBL29525651 0.83 HTR6 (0.32) —
SCHEMBL29525667 0.78 MAPT (0.33) MAPTSMN1; SMN2POLBHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114008043-B Condensed heterocyclic compounds and their use as pest control agents PI工业有限公司 2024-06-07 — — CN claimed
EP-3983411-A1 FUSED HETEROCYCLIC COMPOUNDS AND THEIR USE AS PEST CONTROL AGENTS PI Industries Ltd. (IN) 2022-04-20 — — EP claimed
CN-114008043-A Fused heterocyclic compound and use thereof as pest control agent PI工业有限公司 2022-02-01 — — CN claimed
CN-114008043-B Condensed heterocyclic compounds and their use as pest control agents PI工业有限公司 2024-06-07 — — CN disclosed
EP-3983411-A1 FUSED HETEROCYCLIC COMPOUNDS AND THEIR USE AS PEST CONTROL AGENTS PI Industries Ltd. (IN) 2022-04-20 — — EP disclosed
CN-114008043-A Fused heterocyclic compound and use thereof as pest control agent PI工业有限公司 2022-02-01 — — CN disclosed
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