SCHEMBL30013724

SCHEMBL30013724

O=[N+]([O-])c1ccc2c(Cl)nc3nncn3c2c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HRH4 Q9H3N8 1/20 0.43
▸ HRH3 Q9Y5N1 1/20 0.43
▸ AMY1A P0DUB6 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.38
▸ LCK P06239 1/20 0.38
▸ MAPT P10636 2/20 0.37
▸ FGFR1 P11362 1/20 0.36
▸ ALOX5 P09917 1/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ OPRK1 P41145 1/20 0.36
▸ CDC7 O00311 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ LMNA P02545 2/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ ALOX15 P16050 1/20 0.35
▸ NOS1 P29475 1/20 0.35
▸ ALDH1A1 P00352 3/20 0.35
▸ HTT P42858 3/20 0.35
▸ L3MBTL1 Q9Y468 2/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL23577365 1.00 HRH4 (0.43) HRH4HRH3AMY1AHSD17B10LCK
SCHEMBL30979120 0.84 HRH4 (0.46) HRH4HRH3MAPTFGFR1CDC7
SCHEMBL30979012 0.81 HRH4 (0.43) HRH4HRH3HSD17B10LCKMAPT
SCHEMBL23577370 0.78 HRH4 (0.43) HRH4HRH3MAPTKMT2AKDM4E
SCHEMBL29909232 0.78 HRH4 (0.43) HRH4HRH3MAPTKMT2AKDM4E
SCHEMBL29909609 0.76 KDM4E (0.37) HRH4MAPTKDM4EALDH1A1HTT
SCHEMBL23576802 0.76 KDM4E (0.37) HRH4MAPTKDM4EALDH1A1HTT
SCHEMBL23577151 0.75 ABCG2 (0.47) HRH4HRH3MAPTFGFR1KMT2A
SCHEMBL30014094 0.75 ABCG2 (0.47) HRH4HRH3MAPTFGFR1KMT2A
SCHEMBL23576679 0.75 PARP1 (0.46) HRH4HRH3FGFR1L3MBTL1PARP1

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-118324767-A Diacylglycerol kinase modulating compounds 卡尔那生物科学株式会社 2024-07-12 — — CN disclosed
CN-115362003-A Diacylglycerol kinase modulating compounds 卡尔那生物科学株式会社 2022-11-18 — — CN disclosed
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