SCHEMBL30163641

SCHEMBL30163641

Cc1cc(-c2ccccc2-c2cnn(C)c2)c2cc(C(=O)N3CCOCC3)ccc2n1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CCNC P24863 7/20 0.54
CDK8 P49336 7/20 0.54
HPGD P15428 3/20 0.46
PDCD1 Q15116 1/20 0.43
CD274 Q9NZQ7 1/20 0.43
GRM2 Q14416 1/20 0.42
KDM4E B2RXH2 1/20 0.42
USP2 O75604 1/20 0.42
ALDH1A1 P00352 1/20 0.42
TP53 P04637 1/20 0.42
POLB P06746 1/20 0.42
TSHR P16473 1/20 0.42
HSD17B10 Q99714 1/20 0.42
PDK2 Q15119 1/20 0.42
PIK3CD O00329 1/20 0.42
MAPK10 P53779 1/20 0.42
ACVR1 Q04771 1/20 0.41

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
SCHEMBL31428866 0.93 CCNC (0.58) CCNCCDK8HPGDGRM2KDM4E
SCHEMBL31428537 0.89 PDCD1 (0.52) HPGDPDCD1CD274KDM4EUSP2
SCHEMBL31428426 0.88 CCNC (0.54) CCNCCDK8HPGDGRM2PDK2
SCHEMBL24977242 0.88 CCNC (0.54) CCNCCDK8HPGDGRM2PDK2
SCHEMBL31429061 0.88 CCNC (0.56) CCNCCDK8HPGDPDCD1CD274
SCHEMBL31428513 0.84 PDCD1 (0.53) HPGDPDCD1CD274GRM2KDM4E
SCHEMBL31428786 0.83 CCNC (0.44) CCNCCDK8HPGDPDCD1CD274
SCHEMBL31428699 0.82 HTR2C (0.53) HPGDPDCD1CD274KDM4EUSP2
SCHEMBL31428501 0.82 CCNC (0.49) CCNCCDK8HPGDGRM2KDM4E
SCHEMBL24977216 0.82 CCNC (0.49) CCNCCDK8HPGDGRM2KDM4E

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250091994-A1 RAS/RAF BINDING INHIBITOR COMPOUND NATIONAL UNIVERSITY CORPORATION KOBE UNIVERSITY (JP) 2025-03-20 US disclosed
WO-2023008577-A1 RAS/RAF BINDING INHIBITOR COMPOUND 国立大学法人神戸大学 2023-02-02 WO 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-20250091994-A1 RAS/RAF BINDING INHIBITOR COMPOUND BRAF, RAF1, NRAS CCNC 1310/4885CDK8 1499/4885HPGD 4233/4885

“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.