SCHEMBL29025630

SCHEMBL29025630

COc1cc(Cl)c(C(=O)Cn2ncnn2)cc1Br

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.41
▸ HTR4 Q13639 1/20 0.36
▸ ABCB1 P08183 1/20 0.35
▸ USP2 O75604 3/20 0.33
▸ HSD17B10 Q99714 3/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ HPGD P15428 1/20 0.33
▸ LRRK2 Q5S007 1/20 0.33
▸ MAPT P10636 2/20 0.33
▸ LCK P06239 1/20 0.33
▸ FYN P06241 1/20 0.33
▸ ALDH1A1 P00352 2/20 0.32
▸ TSHR P16473 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ PDE4D Q08499 1/20 0.32
▸ HTR2A P28223 1/20 0.32
▸ HTR2C P28335 1/20 0.32

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
SCHEMBL30356513 1.00 POLB (0.41) POLBHTR4ABCB1USP2HSD17B10
SCHEMBL30356530 0.83 POLB (0.42) POLBMAPTALDH1A1LMNA
SCHEMBL29025627 0.83 POLB (0.42) POLBMAPTALDH1A1LMNA
SCHEMBL29025710 0.81 POLB (0.36) POLB
SCHEMBL30356535 0.77 POLB (0.46) POLBKDM4EHPGDMAPTALDH1A1
SCHEMBL29025637 0.77 POLB (0.46) POLBKDM4EHPGDMAPTALDH1A1
SCHEMBL29025713 0.76 HPGDS (0.45) ABCB1KDM4ELCKFYNALDH1A1
SCHEMBL29025711 0.76 POLB (0.45) POLBALDH1A1
SCHEMBL30356468 0.73 POLB (0.58) POLBKDM4EMAPTALDH1A1MEN1
SCHEMBL2129095 0.71 LCK (0.58) HSD17B10KDM4EHPGDMAPTLCK

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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