SCHEMBL24908614

SCHEMBL24908614

CC(C)c1cnn(-c2ccc(C#N)c(F)c2)c1

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 6/20 0.42
CYP11B2 P19099 6/20 0.42
CACNA1H O95180 1/20 0.40
XDH P47989 1/20 0.38

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
SCHEMBL2609429 0.83 RXRA (0.41) CACNA1H
SCHEMBL24908619 0.82 AR (0.44) XDH
SCHEMBL24908575 0.82 XDH (0.46) CACNA1HXDH
SCHEMBL24908613 0.77 NOTUM (0.41) CYP11B1CYP11B2CACNA1H
SCHEMBL24908515 0.77 CACNA1H (0.39) CACNA1H
SCHEMBL25583760 0.76 CACNA1H (0.53) CYP11B1CYP11B2CACNA1H
SCHEMBL2609425 0.76 RXRA (0.44)
SCHEMBL31517415 0.75 XDH (0.43) XDH
SCHEMBL24908424 0.75 GRM5 (0.54)
SCHEMBL15119356 0.75 KDM5B (0.43)

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-20230014445-A1 ALLOSTERIC CHROMENONE INHIBITORS OF PHOSPHOINOSITIDE 3-KINASE (PI3K) FOR THE TREATMENT OF DISEASE LOXO ONCOLOGY, INC. 2023-01-19 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-20230014445-A1 ALLOSTERIC CHROMENONE INHIBITORS OF PHOSPHOINOSITIDE 3-KINASE (PI3K) FOR THE TREATMENT OF DISEASE PIK3CA, PIK3R4, PIK3R5 CYP11B1 46/4885CYP11B2 124/4885CACNA1H 3105/4885

“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.