SCHEMBL16028930

SCHEMBL16028930

Nc1ccc(Oc2ccnc(-c3ccc(C(F)(F)F)nc3)c2)cn1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ GRM5 P41594 1/20 0.47
▸ CDK8 P49336 6/20 0.43
▸ MTOR P42345 3/20 0.43
▸ ALOX5AP P20292 3/20 0.41
▸ FEN1 P39748 3/20 0.41
▸ SCN9A Q15858 4/20 0.41
▸ CDK7 P50613 1/20 0.41
▸ CDK6 Q00534 1/20 0.41
▸ LTA4H P09960 1/20 0.41
▸ FPR2 P25090 1/20 0.40
▸ SCN10A Q9Y5Y9 1/20 0.39
▸ PIK3CA P42336 2/20 0.39
▸ MAP4K4 O95819 1/20 0.39
▸ KCNH2 Q12809 1/20 0.39
▸ MINK1 Q8N4C8 1/20 0.39
▸ PI4KB Q9UBF8 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
SCHEMBL16028422 0.88 IDO1 (0.46) GRM5CDK8ALOX5APFEN1CDK7
SCHEMBL16028506 0.82 GRM5 (0.45) GRM5SCN9AFPR2SCN10A
SCHEMBL16028599 0.81 LTA4H (0.43) CDK8MTORLTA4HPIK3CA
SCHEMBL23900459 0.81 CDK8 (0.50) CDK8ALOX5APFEN1SCN9ALTA4H
SCHEMBL28460970 0.81 GRM5 (0.50) GRM5SCN9AFPR2SCN10A
SCHEMBL16029265 0.80 LTA4H (0.40) CDK8LTA4H
SCHEMBL27312519 0.79 GRM5 (0.46) GRM5SCN9AFPR2SCN10A
SCHEMBL23888645 0.78 MPO (0.43) CDK8SCN9ALTA4H
SCHEMBL23900460 0.78 ASIC3 (0.50) CDK8LTA4H
SCHEMBL30086973 0.78 MPO (0.43) CDK8SCN9ALTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2968287-B1 N-ACYL-N'-(PYRIDIN-2-YL) UREAS AND ANALOGS EXHIBITING ANTI-CANCER AND ANTI-PROLIFERATIVE ACTIVITIES DECIPHERA PHARMACEUTICALS LLC (US) 2020-06-24 — — EP disclosed
US-9382228-B2 N-acyl-N′-(pyridin-2-yl) ureas and analogs exhibiting anti-cancer and anti-proliferative activities DECIPHERA PHARMACEUTICALS, LLC (US) 2016-07-05 — — US disclosed
EP-2968287-A2 N-ACYL-N'-(PYRIDIN-2-YL) UREAS AND ANALOGS EXHIBITING ANTI-CANCER AND ANTI-PROLIFERATIVE ACTIVITIES Deciphera Pharmaceuticals, LLC (US) 2016-01-20 — — EP disclosed
US-20140275080-A1 N-Acyl-N'-(pyridin-2-yl) Ureas and Analogs Exhibiting Anti-Cancer and Anti-Proliferative Activities DECIPHERA PHARMACEUTICALS, LLC (US) 2014-09-18 — — US disclosed
WO-2014145028-A2 N-ACYL-N'-(PYRIDIN-2-YL) UREAS AND ANALOGS EXHIBITING ANTI-CANCER AND ANTI-PROLIFERATIVE ACTIVITIES DECIPHERA PHARMACEUTICALS, LLC (US) 2014-09-18 — — WO 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-20140275080-A1 N-Acyl-N'-(pyridin-2-yl) Ureas and Analogs Exhibiting Anti-Cancer and Anti-Proliferative Activities KIT, CSF1R, CSF3R GRM5 3755/4885CDK8 147/4885MTOR 1131/4885

“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.

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