SCHEMBL28426398

SCHEMBL28426398

CC1(C)Cc2c(Oc3cc(F)cc(C#N)c3)ncnc2C1O

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ EPAS1 Q99814 18/20 0.48
▸ VEGFA P15692 7/20 0.43
▸ ARNT P27540 2/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43

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
SCHEMBL30136465 1.00 EPAS1 (0.48) EPAS1VEGFAARNTCYP2C9CYP2C19
SCHEMBL28425970 0.88 VEGFA (0.53) EPAS1VEGFAARNTCYP2C9CYP2C19
SCHEMBL28895560 0.88 VEGFA (0.53) EPAS1VEGFAARNTCYP2C9CYP2C19
SCHEMBL30136471 0.88 VEGFA (0.53) EPAS1VEGFAARNTCYP2C9CYP2C19
SCHEMBL28425966 0.88 VEGFA (0.53) EPAS1VEGFAARNTCYP2C9CYP2C19
SCHEMBL30136472 0.88 VEGFA (0.53) EPAS1VEGFAARNTCYP2C9CYP2C19
SCHEMBL28426265 0.79 EPAS1 (0.78) EPAS1VEGFA
SCHEMBL30136495 0.79 EPAS1 (0.78) EPAS1VEGFA
SCHEMBL30136473 0.79 EPAS1 (0.78) EPAS1VEGFA
SCHEMBL28425036 0.79 EPAS1 (0.78) EPAS1VEGFA

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-111303053-A Cyclopenta [ d ] pyrimidine compound and pharmaceutically acceptable salt, solvate or prodrug thereof and application 中国海洋大学 2020-06-19 — — CN claimed
CN-111303053-B Cyclopenta [ d ] pyrimidine compound and pharmaceutically acceptable salt, solvate or prodrug thereof and application 中国海洋大学 2023-01-17 — — CN disclosed
CN-111303053-A Cyclopenta [ d ] pyrimidine compound and pharmaceutically acceptable salt, solvate or prodrug thereof and application 中国海洋大学 2020-06-19 — — CN disclosed
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