SCHEMBL30634255

SCHEMBL30634255

CCOC(=O)/C=C/c1cc2cccnc2cc1OC

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDGFRB P09619 1/20 0.51
▸ PDGFRA P16234 1/20 0.51
▸ FDPS P14324 1/20 0.48
▸ MAOB P27338 1/20 0.47
▸ CCNC P24863 1/20 0.47
▸ CDK8 P49336 1/20 0.47
▸ KDM4E B2RXH2 3/20 0.47
▸ ALDH1A1 P00352 2/20 0.47
▸ GAA P10253 1/20 0.45
▸ AKR1B10 O60218 6/20 0.44
▸ AKR1B1 P15121 6/20 0.44
▸ CYP3A4 P08684 3/20 0.44
▸ DPP4 P27487 1/20 0.43
▸ ALOX15 P16050 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ CYP1A2 P05177 1/20 0.42
▸ CYP2D6 P10635 1/20 0.42
▸ CYP2C9 P11712 1/20 0.42
▸ HSD17B1 P14061 1/20 0.42
▸ CYP2C19 P33261 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
SCHEMBL30634263 0.85 CCNC (0.47) CCNCCDK8KDM4EALDH1A1GAA
SCHEMBL26634035 0.84 PDGFRB (0.57) PDGFRBPDGFRAKDM4EALDH1A1GAA
SCHEMBL30634280 0.82 CCNC (0.47) CCNCCDK8KDM4EALDH1A1GAA
SCHEMBL2383627 0.81 CYP3A4 (0.60) FDPSMAOBCCNCCDK8KDM4E
SCHEMBL3153965 0.81 CYP3A4 (0.60) FDPSMAOBCCNCCDK8KDM4E
SCHEMBL26789790 0.80 FDPS (0.46) FDPSMAOBALDH1A1AKR1B10AKR1B1
SCHEMBL17722573 0.79 MAOB (0.60) FDPSMAOBKDM4EALDH1A1AKR1B10
SCHEMBL2133619 0.78 TTR (0.56) FDPSMAOBCCNCCDK8KDM4E
SCHEMBL3900717 0.77 KDR (0.42) CCNCCDK8KDM4EALDH1A1GAA
SCHEMBL3900719 0.77 KDR (0.42) CCNCCDK8KDM4EALDH1A1GAA

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-20250270187-A1 MOLECULAR EDITING OF MULTIPLE C-H BONDS LEVERAGING RECOGNITION OF DISTANCE, GEOMETRY AND CHIRALITY THE SCRIPPS RESEARCH INSTITUTE 2025-08-28 — — US disclosed
WO-2023212565-A2 MOLECULAR EDITING OF MULTIPLE C-H BONDS BY LEVERAGING RECOGNITION OF DISTANCE, GEOMETRY AND CHIRALITY THE SCRIPPS RESEARCH INSTITUTE (US) 2023-11-02 — — WO 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-20250270187-A1 MOLECULAR EDITING OF MULTIPLE C-H BONDS LEVERAGING RECOGNITION OF DISTANCE, GEOMETRY AND CHIRALITY CYCS, CYC1, CDA PDGFRB 3106/4885PDGFRA 2568/4885FDPS 3483/4885

“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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