SCHEMBL23714520

SCHEMBL23714520

CCNc1cc(O)c(O)cc1C

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.59
TSHR P16473 1/20 0.59
RECQL P46063 1/20 0.59
IDO1 P14902 2/20 0.42
PKM P14618 3/20 0.39
MAPT P10636 4/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
ALDH1A1 P00352 3/20 0.36
KDM4E B2RXH2 3/20 0.36
HPGD P15428 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
G6PD P11413 1/20 0.36
CYP2C9 P11712 1/20 0.36
ALOX15 P16050 1/20 0.36
ALOX12 P18054 1/20 0.36
MAPK1 P28482 1/20 0.36
CYP2C19 P33261 1/20 0.36
CCR6 P51684 1/20 0.36
HIF1A Q16665 1/20 0.36

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
SCHEMBL26429542 0.84 CYP3A4 (0.52) CYP3A4TSHRRECQLIDO1PKM
SCHEMBL5685122 0.81 TSHR (0.47) CYP3A4TSHRRECQLIDO1PKM
SCHEMBL9750778 0.80 CYP3A4 (0.50) CYP3A4TSHRRECQLIDO1PKM
SCHEMBL21635493 0.79 CYP3A4 (0.47) CYP3A4TSHRRECQLIDO1PKM
SCHEMBL24240008 0.79 CYP3A4 (0.47) CYP3A4TSHRRECQLIDO1PKM
SCHEMBL26299582 0.77 HCAR3 (0.49) CYP3A4TSHRRECQLMAPTSMN1; SMN2
SCHEMBL10364104 0.75 CYP3A4 (0.47) CYP3A4TSHRRECQLIDO1PKM
SCHEMBL15018391 0.75 TSHR (0.47) CYP3A4TSHRRECQLIDO1PKM
SCHEMBL20612556 0.74 CYP3A4 (0.71) CYP3A4TSHRRECQLIDO1MAPT
SCHEMBL126869 0.74 TSHR (1.00) CYP3A4TSHRRECQLIDO1MAPT

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-20210236657-A1 NERVE-SPECIFIC FLUOROPHORE FORMULATIONS FOR DIRECT AND SYSTEMIC ADMINISTRATION OREGON HEALTH & SCIENCE UNIVERSITY (US) 2021-08-05 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-20210236657-A1 NERVE-SPECIFIC FLUOROPHORE FORMULATIONS FOR DIRECT AND SYSTEMIC ADMINISTRATION PFAS, NPFFR2, NPFFR1 CYP3A4 1609/4885TSHR 2396/4885RECQL 556/4885

“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.