SCHEMBL30356525

SCHEMBL30356525

[2H]c1cc(Cl)c(C(=O)Cn2ncnn2)cc1[2H]

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.46
▸ ALDH1A1 P00352 4/20 0.35
▸ MAPT P10636 3/20 0.35
▸ RAB9A P51151 3/20 0.32
▸ SMN1; SMN2 Q16637 2/20 0.32
▸ P2RX7 Q99572 3/20 0.32
▸ CXCR3 P49682 1/20 0.32
▸ MAPK1 P28482 1/20 0.31
▸ HIF1A Q16665 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ HSP90AA1 P07900 1/20 0.31
▸ PAX8 Q06710 1/20 0.31
▸ F10 P00742 1/20 0.30
▸ MGAM O43451 1/20 0.30
▸ AMY1A P0DUB6 1/20 0.30
▸ GAA P10253 1/20 0.30
▸ SI P14410 1/20 0.30
▸ MGAM2 Q2M2H8 1/20 0.30
▸ LMNA P02545 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
SCHEMBL1682664 0.85 POLB (0.58) POLBALDH1A1MAPTRAB9ASMN1; SMN2
SCHEMBL30356468 0.85 POLB (0.58) POLBALDH1A1MAPTRAB9ASMN1; SMN2
SCHEMBL6558564 0.81 ALDH1A1 (0.53) POLBALDH1A1MAPTRAB9ASMN1; SMN2
SCHEMBL29025711 0.79 POLB (0.45) POLBALDH1A1P2RX7MAPK1HIF1A
SCHEMBL30356535 0.78 POLB (0.46) POLBALDH1A1MAPTSMN1; SMN2LMNA
SCHEMBL29025637 0.78 POLB (0.46) POLBALDH1A1MAPTSMN1; SMN2LMNA
SCHEMBL30356530 0.73 POLB (0.42) POLBALDH1A1MAPTP2RX7MAPK1
SCHEMBL29025627 0.73 POLB (0.42) POLBALDH1A1MAPTP2RX7MAPK1
SCHEMBL6556649 0.73 MAPT (0.48) POLBALDH1A1MAPTRAB9ASMN1; SMN2
SCHEMBL7783928 0.69 HPGD (0.55) POLBALDH1A1MAPTRAB9ASMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116143717-B Deuterated carbamate compound and application thereof in medicine 康百达(四川)生物医药科技有限公司 2025-05-06 — — CN disclosed
CN-116143717-A Deuterated carbamate compound and application thereof in medicine 成都百裕制药股份有限公司 2023-05-23 — — CN disclosed
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