SCHEMBL22683074

SCHEMBL22683074

C#Cc1cncc(C(=O)Nc2cccc(C(F)(F)F)c2)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.65
KMT2A Q03164 2/20 0.65
TSHR P16473 1/20 0.65
MAPT P10636 3/20 0.60
LCK P06239 3/20 0.57
TEK Q02763 1/20 0.57
USP36 Q9P275 1/20 0.57
RXFP1 Q9HBX9 2/20 0.54
KIT P10721 2/20 0.54
SRC P12931 2/20 0.54
MAPK14 Q16539 2/20 0.54
KDM4E B2RXH2 1/20 0.54
SAE1 Q9UBE0 1/20 0.54
UBA2 Q9UBT2 1/20 0.54
KCNK3 O14649 1/20 0.53
KDR P35968 2/20 0.53
CSF1R P07333 1/20 0.53
CCNC P24863 1/20 0.52
CDK8 P49336 1/20 0.52
LMNA P02545 2/20 0.52

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
SCHEMBL31314816 1.00 MEN1 (0.65) MEN1KMT2ATSHRMAPTLCK
SCHEMBL17936093 0.85 MAPT (0.74) MEN1KMT2ATSHRMAPTLCK
SCHEMBL17818404 0.83 MAPT (0.70) MEN1KMT2ATSHRMAPTLCK
SCHEMBL2974953 0.82 LCK (0.81) MEN1KMT2ATSHRMAPTLCK
SCHEMBL15238766 0.81 MEN1 (0.75) MEN1KMT2ATSHRMAPTLCK
SCHEMBL16782133 0.80 KDR (0.67) MEN1KMT2ATSHRMAPTLCK
SCHEMBL17818365 0.80 MAPT (0.66) MEN1KMT2AMAPTRXFP1KCNK3
SCHEMBL22384740 0.79 LCK (0.67) MEN1KMT2ATSHRMAPTLCK
SCHEMBL31314801 0.79 KDR (0.53) MEN1KMT2AMAPTKITKDR
SCHEMBL26131577 0.79 KDR (0.53) MEN1KMT2AMAPTKITKDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250243203-A1 NICOTINAMIDE- AND BENZAMIDE-BASED COMPOUNDS, CONJUGATES, AND COMPOSITIONS AS INHIBITORS OF TRANSLATIONAL- AND TRANSCRIPTIONAL-RELATED KINASES PURDUE RESEARCH FOUNDATION 2025-07-31 US disclosed
EP-4504174-A2 NICOTINAMIDE- AND BENZAMIDE-BASED COMPOUNDS, CONJUGATES, AND COMPOSITIONS AS INHIBITORS OF TRANSLATIONAL- AND TRANSCRIPTIONAL-RELATED KINASES Purdue Research Foundation (US) 2025-02-12 EP disclosed
WO-2023196930-A2 NICOTINAMIDE- AND BENZAMIDE-BASED COMPOUNDS, CONJUGATES, AND COMPOSITIONS AS INHIBITORS OF TRANSLATIONAL- AND TRANSCRIPTIONAL-RELATED KINASES PURDUE RESEARCH FOUNDATION (US) 2023-10-12 WO disclosed
WO-2023196930-A2 NICOTINAMIDE- AND BENZAMIDE-BASED COMPOUNDS, CONJUGATES, AND COMPOSITIONS AS INHIBITORS OF TRANSLATIONAL- AND TRANSCRIPTIONAL-RELATED KINASES PURDUE RESEARCH FOUNDATION (US) 2023-10-12 WO disclosed
US-20230219934-A1 2,3-DISUBSTITUTED PYRIDO[3,4-B]PYRAZINE-CONTAINING COMPOUNDS AS KINASE INHIBITORS PURDUE RESEARCH FOUNDATION (US) 2023-07-13 US disclosed
US-20230219934-A1 2,3-DISUBSTITUTED PYRIDO[3,4-B]PYRAZINE-CONTAINING COMPOUNDS AS KINASE INHIBITORS PURDUE RESEARCH FOUNDATION (US) 2023-07-13 US disclosed
US-20230219934-A1 2,3-DISUBSTITUTED PYRIDO[3,4-B]PYRAZINE-CONTAINING COMPOUNDS AS KINASE INHIBITORS PURDUE RESEARCH FOUNDATION (US) 2023-07-13 US disclosed
WO-2021262915-A1 2,3-DISUBSTITUTED PYRIDO[3,4-B]PYRAZINE-CONTAINING COMPOUNDS AS KINASE INHIBITORS PURDUE RESEARCH FOUNDATION (US) 2021-12-30 WO disclosed
EP-3284738-B1 5-AROMATIC ALKYNYL SUBSTITUTED BENZAMIDE COMPOUND AND PREPARATION METHOD, PHARMACEUTICAL COMPOSITION, AND USE THEREOF SHANGHAI INST MATERIA MEDICA CAS (CN) 2020-11-25 EP 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 (2 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-20230219934-A1 2,3-DISUBSTITUTED PYRIDO[3,4-B]PYRAZINE-CONTAINING COMPOUNDS AS KINASE INHIBITORS MAP3K2, MAP4K2, MAP3K5 MEN1 2753/4885KMT2A 797/4885TSHR 2415/4885
US-20250243203-A1 NICOTINAMIDE- AND BENZAMIDE-BASED COMPOUNDS, CONJUGATES, AND COMPOSITIONS AS INHIBITORS OF TRANSLATIONAL- AND TRANSCRIPTIONAL-RELATED KINASES NADK, NAMPT, NNMT MEN1 2850/4885KMT2A 349/4885TSHR 3446/4885

“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.