SCHEMBL28503276

SCHEMBL28503276

NC(=O)COc1ccc2cn[nH]c2c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ROCK2 O75116 3/20 0.48
▸ ROCK1 Q13464 2/20 0.48
▸ GRK2 P25098 1/20 0.47
▸ KDM4E B2RXH2 4/20 0.46
▸ MEN1 O00255 3/20 0.46
▸ KMT2A Q03164 3/20 0.46
▸ MAPT P10636 3/20 0.46
▸ PKM P14618 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ FGFR1 P11362 3/20 0.46
▸ FGFR2 P21802 3/20 0.46
▸ FGFR3 P22607 2/20 0.46
▸ NEK2 P51955 1/20 0.44
▸ NOS1 P29475 2/20 0.42
▸ DYRK1A Q13627 2/20 0.42
▸ METAP2 P50579 1/20 0.42
▸ INSR P06213 1/20 0.42
▸ IGF1R P08069 1/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ LMNA P02545 1/20 0.42

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
SCHEMBL19555316 0.87 PTPN7 (0.55) ROCK2ROCK1KDM4EMEN1KMT2A
SCHEMBL30025182 0.87 PTPN7 (0.55) ROCK2ROCK1KDM4EMEN1KMT2A
SCHEMBL16179479 0.82 ALDH1A1 (0.52) ROCK2ROCK1KDM4EMEN1KMT2A
Trifluoroacetic Acid SCHEMBL20974298 0.80 PTPN7 (0.48) ROCK2ROCK1KDM4EMEN1KMT2A
SCHEMBL20999628 0.80 MEN1 (0.48) ROCK2ROCK1KDM4EMEN1KMT2A
SCHEMBL20973915 0.78 ATF4 (0.53) MEN1KMT2APOLB
SCHEMBL28496067 0.78 MEN1 (0.43) KDM4EMEN1KMT2AMAPTPKM
SCHEMBL30075985 0.78 ATF4 (0.53) MEN1KMT2APOLB
SCHEMBL16711152 0.76 FGFR2 (0.71) KDM4EMEN1KMT2AMAPTPKM
SCHEMBL8059741 0.76 PDE3B (0.52) ROCK2ROCK1KDM4EMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115947681-A Modulators of integrated stress pathways 卡里科生命科学有限责任公司 2023-04-11 — — CN disclosed
CN-109641844-B Modulators of integrated stress pathways 卡里科生命科学有限责任公司 2022-11-01 — — CN disclosed
CN-112189008-A Modulators of integrated stress pathways 卡里科生命科学有限责任公司 2021-01-05 — — CN disclosed
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