SCHEMBL24240729

SCHEMBL24240729

CC(=O)NC(Cn1ccnc1)c1ccccc1

nearest known ligand 0.74

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP26A1 O43174 5/20 0.53
POLB P06746 1/20 0.53
HMOX2 P30519 1/20 0.52
CYP19A1 P11511 2/20 0.51
AURKA O14965 1/20 0.50
PDPK1 O15530 1/20 0.50
RPS6KB1 P23443 1/20 0.50
MAPK1 P28482 1/20 0.48
PTGS2 P35354 1/20 0.48

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
SCHEMBL24240734 0.81 CYP26A1 (0.72) CYP26A1RPS6KB1MAPK1
SCHEMBL3101929 0.79 ROCK1 (0.67) CYP26A1RPS6KB1MAPK1
SCHEMBL24240727 0.78 CYP26A1 (0.64) CYP26A1RPS6KB1MAPK1
SCHEMBL28796560 0.77 CYP26A1 (0.60) CYP26A1POLBHMOX2CYP19A1
SCHEMBL25335798 0.76 CYP19A1 (0.67) CYP26A1POLBHMOX2CYP19A1PTGS2
SCHEMBL7082419 0.76 TBXAS1 (0.67) POLBHMOX2CYP19A1
SCHEMBL24240730 0.75 CYP51A1 (0.70) CYP26A1
SCHEMBL28557139 0.74 UTS2R (0.46) POLB
SCHEMBL10652258 0.74 CYP19A1 (0.69) POLBHMOX2CYP19A1
SCHEMBL11731922 0.73 HMOX2 (0.56) POLBHMOX2CYP19A1

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 58/4885POLB 469/4885HMOX2 1229/4885

“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.