SCHEMBL25138359

SCHEMBL25138359

COC(=O)c1cnc(Cn2ccc3cc(C(=O)NC4CC4)cnc32)c(F)c1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ HPGDS O60760 11/20 0.42
▸ RIPK2 O43353 1/20 0.41
▸ MCHR1 Q99705 2/20 0.40
▸ CYP2C9 P11712 4/20 0.40
▸ MAPK11 Q15759 3/20 0.40
▸ MAPK14 Q16539 3/20 0.40
▸ BUB1 O43683 1/20 0.40
▸ PRKACG P22612 1/20 0.40
▸ MAPKAPK2 P49137 1/20 0.40
▸ ACSL5 Q9ULC5 1/20 0.40
▸ STK24 Q9Y6E0 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ RXFP1 Q9HBX9 1/20 0.39

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
SCHEMBL23167369 0.90 HDAC3 (0.41) HPGDSMCHR1CYP2C9MAPK11MAPK14
SCHEMBL29779623 0.90 HDAC3 (0.41) HPGDSMCHR1CYP2C9MAPK11MAPK14
SCHEMBL23167484 0.87 FGFR1 (0.45) HPGDSMCHR1
SCHEMBL23167492 0.82 FGFR1 (0.48) CYP2C9KDM4EALDH1A1CYP3A4HPGD
SCHEMBL31403654 0.73 PSMD14 (0.45) KDM4EALDH1A1HPGD
SCHEMBL23885053 0.71 PSMD14 (0.43) CYP2C9KDM4EALDH1A1LMNACYP3A4
SCHEMBL23201985 0.70 SLC22A12 (0.44) —
SCHEMBL23167363 0.70 FGFR1 (0.48) —
SCHEMBL31403633 0.68 PSMD14 (0.43) KDM4EALDH1A1HPGDNPSR1
SCHEMBL10179056 0.67 EGLN1 (0.39) CYP2C9KDM4EALDH1A1LMNACYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230123856-A1 5-FLUORONICOTINAMIDE DERIVATIVES AND USES THEREOF TENAYA THERAPEUTICS, INC. (US) 2023-04-20 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230123856-A1 5-FLUORONICOTINAMIDE DERIVATIVES AND USES THEREOF SLC28A1, SLC5A1, SLC9A5 HPGDS 4651/4885RIPK2 4149/4885MCHR1 3395/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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