SCHEMBL21711087

SCHEMBL21711087

CCCC(C)c1cc(C)ncc1C

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
UHRF1 Q96T88 1/20 0.35
HCAR2 Q8TDS4 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2A6 P11509 1/20 0.31
CA12 O43570 1/20 0.30
CA2 P00918 1/20 0.30
CA9 Q16790 1/20 0.30

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
SCHEMBL22871206 0.87 UHRF1 (0.41) UHRF1HCAR2CYP1A2CYP2A6
SCHEMBL24936534 0.82 AAK1 (0.33) HCAR2
SCHEMBL23082855 0.77 CRHR1 (0.38)
SCHEMBL10222485 0.76 UHRF1 (0.43) UHRF1CYP1A2CYP2A6CA2
SCHEMBL10528142 0.75 NPC1 (0.34)
SCHEMBL24936531 0.73 AAK1 (0.32)
SCHEMBL22679386 0.72 UHRF1 (0.40) UHRF1CYP1A2CYP2A6
SCHEMBL21711177 0.72 NOS3 (0.38)
SCHEMBL21725470 0.71 UHRF1 (0.43) UHRF1CYP1A2CYP2A6
SCHEMBL22299472 0.70 CNR2 (0.32) UHRF1CYP1A2CYP2A6

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-20200048267-A1 OGA INHIBITOR COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2020-02-13 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-20200048267-A1 OGA INHIBITOR COMPOUNDS OGA, OGT, GRN UHRF1 876/4885HCAR2 4444/4885CYP1A2 4439/4885

“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.