SCHEMBL23928381

SCHEMBL23928381

Nc1nccc(C2CCCCC2)c1F

nearest known ligand 0.43

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FEN1 P39748 19/20 0.43
ALOX5AP P20292 12/20 0.41
TDO2 P48775 1/20 0.40

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
SCHEMBL5776461 0.81 TDO2 (0.42) FEN1ALOX5APTDO2
SCHEMBL5776718 0.81 TDO2 (0.42) FEN1ALOX5APTDO2
SCHEMBL5775480 0.81 TDO2 (0.42) FEN1ALOX5APTDO2
SCHEMBL28284231 0.79 TDO2 (0.40) FEN1ALOX5APTDO2
SCHEMBL2718434 0.74 CYP11B2 (0.43) FEN1ALOX5APTDO2
SCHEMBL27952428 0.74 CEL (0.44) FEN1ALOX5APTDO2
SCHEMBL5954915 0.72 NOS1 (0.42) FEN1ALOX5APTDO2
SCHEMBL29526095 0.71 NOS3 (0.45) FEN1ALOX5APTDO2
SCHEMBL928999 0.71 NOS3 (0.45) FEN1ALOX5APTDO2
SCHEMBL19723920 0.70 TDO2 (0.42) FEN1ALOX5APTDO2

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
US-12018030-B2 Pyrrolo and pyrazolopyrimidines as ubiquitin-specific protease 7 inhibitors VALO HEALTH, INC. (US) 2024-06-25 US disclosed
US-20210332052-A1 PYRROLO AND PYRAZOLOPYRIMIDINES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS VALO HEALTH, INC. 2021-10-28 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 (2 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-12018030-B2 Pyrrolo and pyrazolopyrimidines as ubiquitin-specific protease 7 inhibitors USP7, UBA7, UBXN1 FEN1 976/4885ALOX5AP 2107/4885TDO2 2006/4885
US-20210332052-A1 PYRROLO AND PYRAZOLOPYRIMIDINES AS UBIQUITIN-SPECIFIC PROTEASE 7 INHIBITORS USP7, UBA7, UBXN1 FEN1 976/4885ALOX5AP 2107/4885TDO2 2006/4885

“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.