SCHEMBL23929340

SCHEMBL23929340

Nc1nc2cnc(Cl)nc2n1C1CCOCC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 6/20 0.39
▸ ALDH1A1 P00352 4/20 0.39
▸ HSD17B10 Q99714 3/20 0.39
▸ CYP3A4 P08684 2/20 0.39
▸ CLK4 Q9HAZ1 3/20 0.39
▸ JAK2 O60674 3/20 0.37
▸ JAK1 P23458 3/20 0.37
▸ MEN1 O00255 4/20 0.36
▸ KMT2A Q03164 4/20 0.36
▸ ALOX15 P16050 2/20 0.36
▸ CASP1 P29466 2/20 0.36
▸ CASP7 P55210 2/20 0.36
▸ CYP2C9 P11712 2/20 0.36
▸ GLA P06280 1/20 0.36
▸ JAK3 P52333 2/20 0.36
▸ MAPK8 P45983 3/20 0.35
▸ MAPK14 Q16539 3/20 0.35
▸ MAPK9 P45984 2/20 0.35
▸ MAPK10 P53779 2/20 0.35
▸ CCNE2 O96020 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
SCHEMBL29987032 1.00 CYP1A2 (0.39) CYP1A2ALDH1A1HSD17B10CYP3A4CLK4
SCHEMBL23929329 0.86 CYP1A2 (0.41) CYP1A2ALDH1A1HSD17B10CYP3A4CLK4
SCHEMBL29987849 0.86 CYP1A2 (0.41) CYP1A2ALDH1A1HSD17B10CYP3A4CLK4
SCHEMBL23929314 0.83 CYP1A2 (0.33) CYP1A2ALDH1A1HSD17B10CYP3A4CLK4
SCHEMBL29987360 0.83 CYP1A2 (0.33) CYP1A2ALDH1A1HSD17B10CYP3A4CLK4
SCHEMBL23929316 0.83 MAPK8 (0.42) CYP1A2ALDH1A1HSD17B10CYP3A4CLK4
SCHEMBL29987529 0.83 MAPK8 (0.42) CYP1A2ALDH1A1HSD17B10CYP3A4CLK4
SCHEMBL29986491 0.81 CYP1A2 (0.34) CYP1A2ALDH1A1HSD17B10CYP3A4MEN1
SCHEMBL23929301 0.81 CYP1A2 (0.34) CYP1A2ALDH1A1HSD17B10CYP3A4MEN1
SCHEMBL16084167 0.79 CYP11B2 (0.43) CYP1A2CYP3A4JAK2JAK1JAK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113493471-B Heteroaromatic kinase inhibitors 山东轩竹医药科技有限公司 2024-06-11 — — CN disclosed
CN-116023393-A Crystal forms of tricyclic kinase inhibitors 山东轩竹医药科技有限公司 2023-04-28 — — CN disclosed
CN-116023394-A Crystal forms of tricyclic kinase inhibitors 山东轩竹医药科技有限公司 2023-04-28 — — CN disclosed
CN-116023395-A Crystal forms of tricyclic kinase inhibitors 山东轩竹医药科技有限公司 2023-04-28 — — CN disclosed
CN-113549092-B Tricyclic kinase inhibitors 山东轩竹医药科技有限公司 2022-10-18 — — CN disclosed
WO-2021213460-A1 TRICYCLIC KINASE INHIBITOR 山东轩竹医药科技有限公司 (CN) 2021-10-28 — — WO disclosed
WO-2021213460-A1 TRICYCLIC KINASE INHIBITOR 山东轩竹医药科技有限公司 (CN) 2021-10-28 — — WO disclosed
CN-113549092-A Tricyclic kinase inhibitors 山东轩竹医药科技有限公司 2021-10-26 — — CN disclosed
CN-113493471-A Heteroaromatic kinase inhibitors 山东轩竹医药科技有限公司 2021-10-12 — — CN disclosed
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