SCHEMBL23746372

SCHEMBL23746372

Cc1ccccc1C(=O)Nc1nc(NC(=O)c2ccc(F)cn2)nn1-c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 3/20 0.54
CDKN1A P38936 1/20 0.48
KDM4E B2RXH2 2/20 0.46
ALDH1A1 P00352 3/20 0.45
LMNA P02545 3/20 0.45
KMT2A Q03164 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
MEN1 O00255 1/20 0.45
HTT P42858 1/20 0.45
HIF1A Q16665 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
NTRK1 P04629 7/20 0.45
POLB P06746 1/20 0.44
NR3C1 P04150 1/20 0.43
GLA P06280 1/20 0.42
TP53 P04637 1/20 0.42
MAPT P10636 1/20 0.42
P4HTM Q9NXG6 1/20 0.42

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
SCHEMBL20110241 0.87 MAPK1 (0.56) MAPK1CDKN1AKDM4EALDH1A1LMNA
SCHEMBL19668480 0.87 MAPK1 (0.69) MAPK1CDKN1AKDM4EALDH1A1LMNA
SCHEMBL20110245 0.85 MAPK1 (0.58) MAPK1CDKN1AKDM4EALDH1A1LMNA
SCHEMBL22060702 0.85 MAPK1 (0.58) MAPK1CDKN1AKDM4EALDH1A1LMNA
SCHEMBL20110231 0.85 MAPK1 (0.60) MAPK1CDKN1AKDM4EALDH1A1LMNA
SCHEMBL22060155 0.85 MAPK1 (0.55) MAPK1CDKN1AKDM4EALDH1A1LMNA
SCHEMBL22060701 0.84 MAPK1 (0.54) MAPK1CDKN1AKDM4EALDH1A1LMNA
SCHEMBL20110191 0.83 MAPK1 (0.79) MAPK1CDKN1AKDM4EALDH1A1LMNA
SCHEMBL20110192 0.83 MAPK1 (0.79) MAPK1CDKN1AKDM4EALDH1A1LMNA
SCHEMBL22060333 0.83 MAPK1 (0.55) MAPK1CDKN1AKDM4EALDH1A1LMNA

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-20210244712-A1 METHODS FOR TREATING PATIENTS WITH CANCER HAVING DEFECTS IN CYCLIN D REGULATION NYSNOBIO IRELAND DAC (IE) 2021-08-12 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-20210244712-A1 METHODS FOR TREATING PATIENTS WITH CANCER HAVING DEFECTS IN CYCLIN D REGULATION TP53, RB1, CDK1 MAPK1 723/4885CDKN1A 7/4885KDM4E 1308/4885

“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.