SCHEMBL25986910

SCHEMBL25986910

CCc1ccnc(-c2nnco2)n1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 11/20 0.39
TP53 P04637 2/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
KDM4E B2RXH2 4/20 0.34
ALDH1A1 P00352 4/20 0.34
MAPT P10636 2/20 0.34
LMNA P02545 1/20 0.34
HTT P42858 1/20 0.34
HPGD P15428 3/20 0.33
MAPK1 P28482 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
HSD17B10 Q99714 2/20 0.33

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
SCHEMBL24921789 0.83 NPC1 (0.38) NOTUMNPC1RAB9AALDH1A1MAPT
SCHEMBL25986827 0.74 NOTUM (0.39) NOTUMTP53NPC1RAB9AKDM4E
SCHEMBL25693366 0.74 NOTUM (0.46) NOTUMKDM4EALDH1A1MAPTLMNA
SCHEMBL24920787 0.74 ALDH1A1 (0.43) NOTUMNPC1RAB9AKDM4EALDH1A1
SCHEMBL24922191 0.71 RAB9A (0.50) NOTUMTP53NPC1RAB9AMAPT
SCHEMBL24922122 0.71 RAB9A (0.40) NOTUMNPC1RAB9AALDH1A1MAPT
SCHEMBL23370157 0.71 CYP1A2 (0.39) KDM4EALDH1A1
SCHEMBL28394924 0.70 NOTUM (0.50) NOTUMKDM4ERXFP1
SCHEMBL21547876 0.70 ACACB (0.40) NOTUMTP53NPC1RAB9AKDM4E
SCHEMBL25986790 0.69 TSHR (0.37) NOTUMTP53NPC1RAB9AALDH1A1

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-20230257352-A1 RAF KINASE INHIBITORS AND METHODS OF USE THEREOF DECIPHERA PHARMACEUTICALS, LLC 2023-08-17 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-20230257352-A1 RAF KINASE INHIBITORS AND METHODS OF USE THEREOF BRAF, RAF1, ARAF NOTUM 3620/4885TP53 62/4885NPC1 2922/4885

“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.