SCHEMBL31428501

SCHEMBL31428501

CCn1cc(-c2cc(C)nc3ccc(C(=O)N4CCOCC4)cc23)cn1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNC P24863 1/20 0.49
CDK8 P49336 1/20 0.49
HPGD P15428 4/20 0.42
GRM2 Q14416 1/20 0.42
AR P10275 1/20 0.41
KDM4E B2RXH2 4/20 0.41
ALDH1A1 P00352 3/20 0.41
CYP1A2 P05177 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
PKM P14618 2/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
PTGER4 P35408 1/20 0.40
HSD17B10 Q99714 2/20 0.40
SRC P12931 1/20 0.40
PIK3CD O00329 1/20 0.40
GAA P10253 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
CNR2 P34972 1/20 0.39

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
SCHEMBL24977216 1.00 CCNC (0.49) CCNCCDK8HPGDGRM2AR
SCHEMBL31428866 0.88 CCNC (0.58) CCNCCDK8HPGDGRM2AR
SCHEMBL31428969 0.88 CCNC (0.49) CCNCCDK8HPGDGRM2AR
SCHEMBL31428513 0.83 PDCD1 (0.53) HPGDGRM2KDM4EALDH1A1PKM
SCHEMBL30163641 0.82 CCNC (0.54) CCNCCDK8HPGDGRM2KDM4E
SCHEMBL31429010 0.82 AR (0.61) CCNCCDK8HPGDGRM2AR
SCHEMBL31428786 0.82 CCNC (0.44) CCNCCDK8HPGDGRM2AR
SCHEMBL31429061 0.81 CCNC (0.56) CCNCCDK8HPGDPIK3CDMEN1
SCHEMBL31428834 0.81 GRM2 (0.48) HPGDGRM2ARKDM4EALDH1A1
SCHEMBL31429056 0.81 MAPT (0.54) HPGDARALDH1A1LMNAMAPT

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-20250091994-A1 RAS/RAF BINDING INHIBITOR COMPOUND NATIONAL UNIVERSITY CORPORATION KOBE UNIVERSITY (JP) 2025-03-20 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-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.