SCHEMBL19115601

SCHEMBL19115601

Cc1ccc2[nH]nc(C(N)=O)c2c1C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAP2K4 P45985 5/20 0.38
▸ MAPK1 P28482 2/20 0.38
▸ MAPKAPK2 P49137 2/20 0.38
▸ MAPK6 Q16659 2/20 0.38
▸ MAPKAPK3 Q16644 1/20 0.38
▸ MAPKAPK5 Q8IW41 1/20 0.38
▸ JAK2 O60674 1/20 0.36
▸ JAK1 P23458 1/20 0.36
▸ TYK2 P29597 1/20 0.36
▸ JAK3 P52333 1/20 0.36
▸ KDM4E B2RXH2 2/20 0.35
▸ CTNNB1 P35222 1/20 0.35
▸ WNT3A P56704 1/20 0.35
▸ YTHDC1 Q96MU7 1/20 0.34
▸ STAT3 P40763 1/20 0.34
▸ HIF1A Q16665 1/20 0.34
▸ NTRK1 P04629 1/20 0.34
▸ WNT1 P04628 1/20 0.34
▸ CLK2 P49760 1/20 0.34
▸ CLK3 P49761 1/20 0.34

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
SCHEMBL25696142 0.81 MAP2K4 (0.35) MAP2K4MAPK1MAPKAPK2MAPK6MAPKAPK3
SCHEMBL19115954 0.81 JAK2 (0.41) MAP2K4MAPK1MAPKAPK2MAPK6MAPKAPK3
SCHEMBL19104287 0.81 MAP2K4 (0.38) MAP2K4MAPK1MAPKAPK2MAPK6MAPKAPK3
SCHEMBL25669188 0.81 YTHDC1 (0.53) MAPK1JAK2JAK1TYK2JAK3
SCHEMBL2723270 0.80 MAP2K4 (0.49) MAP2K4MAPK1MAPKAPK2MAPK6KDM4E
SCHEMBL23206119 0.73 GAA (0.35) MAP2K4MAPK1MAPKAPK2MAPK6KDR
SCHEMBL25667658 0.73 MAPK1 (0.40) MAP2K4MAPK1MAPKAPK2MAPK6MAPKAPK3
SCHEMBL2660353 0.73 PDPK1 (0.47) JAK2KDM4ENTRK1CLK2DYRK1A
SCHEMBL18408664 0.72 CYP1A2 (0.37) MAP2K4MAPK1MAPKAPK2MAPK6DYRK1A
SCHEMBL1648452 0.71 MAP2K4 (0.44) MAP2K4JAK2KDM4EYTHDC1STAT3

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-20230203018-A1 COVALENT INHIBITORS OF KRAS ARAXES PHARMA LLC (US) 2023-06-29 — — US disclosed
US-20170197945-A1 2-SUBSTITUTED QUINAZOLINE COMPOUNDS COMPRISING A SUBSTITUTED HETEROCYCLIC GROUP AND METHODS OF USE THEREOF ARAXES PHARMA LLC 2017-07-13 — — 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 (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-20230203018-A1 COVALENT INHIBITORS OF KRAS KRAS, NRAS, HRAS MAP2K4 340/4885MAPK1 146/4885MAPKAPK2 1080/4885
US-20170197945-A1 2-SUBSTITUTED QUINAZOLINE COMPOUNDS COMPRISING A SUBSTITUTED HETEROCYCLIC GROUP AND METHODS OF USE THEREOF KRAS, NRAS, HRAS MAP2K4 327/4885MAPK1 197/4885MAPKAPK2 794/4885

“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.

Send feedback