SCHEMBL24240734

SCHEMBL24240734

O=C(NC(Cn1ccnc1)c1ccccc1)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.87

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP26A1 O43174 5/20 0.72
CYP51A1 Q16850 4/20 0.59
GSK3B P49841 4/20 0.59
ROCK1 Q13464 4/20 0.59
CLK4 Q9HAZ1 4/20 0.59
RPS6KA5 O75582 3/20 0.59
AKT1 P31749 3/20 0.59
NEK4 P51957 3/20 0.59
PRKCD Q05655 3/20 0.59
PRKG2 Q13237 3/20 0.59
PRKG1 Q13976 3/20 0.59
PKN2 Q16513 3/20 0.59
GSK3A P49840 3/20 0.59
MAPK13 O15264 2/20 0.59
ROCK2 O75116 2/20 0.59
MAP4K4 O95819 2/20 0.59
PRKCG P05129 2/20 0.59
CDK1 P06493 2/20 0.59
RPS6KB1 P23443 2/20 0.59
CDK2 P24941 2/20 0.59

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
SCHEMBL3101929 0.95 ROCK1 (0.67) CYP26A1CYP51A1GSK3BROCK1CLK4
SCHEMBL24240727 0.93 CYP26A1 (0.64) CYP26A1CYP51A1GSK3BROCK1CLK4
SCHEMBL24240730 0.90 CYP51A1 (0.70) CYP26A1CYP51A1
SCHEMBL24240729 0.81 CYP26A1 (0.53) CYP26A1RPS6KB1MAPK1
SCHEMBL28423309 0.78 CYP26A1 (0.61) CYP26A1CYP51A1CYP1A2CYP3A4CYP2D6
SCHEMBL201689 0.77 CYP26A1 (0.67) CYP26A1CYP51A1CYP1A2CYP3A4CYP2D6
SCHEMBL8540526 0.76 CYP26A1 (0.53) CYP26A1CYP51A1CYP1A2CYP3A4CYP2D6
SCHEMBL21072774 0.76 CYP51A1 (1.00) CYP51A1
SCHEMBL21072773 0.76 CYP51A1 (1.00) CYP51A1
SCHEMBL3112675 0.75 ROCK2 (0.80) GSK3BROCK1CLK4RPS6KA5AKT1

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-11241417-B2 Compositions and methods for the treatment and prevention of neurological disorders YUMANITY THERAPEUTICS, INC. (US) 2022-02-08 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-11241417-B2 Compositions and methods for the treatment and prevention of neurological disorders TARDBP, CYP51A1, TDP1 CYP26A1 58/4885CYP51A1 2/4885GSK3B 530/4885

“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.