SCHEMBL3384191

SCHEMBL3384191

Cn1cc(-c2cc(-c3cc(Cl)ccc3F)nc3ncccc23)c2ccncc2c1=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.42
BRD4 O60885 11/20 0.41
TGFBR1 P36897 6/20 0.41
CYP1A2 P05177 4/20 0.41
CYP3A4 P08684 3/20 0.41
TAF1 P21675 2/20 0.38
ACVR1 Q04771 2/20 0.38
CREBBP Q92793 2/20 0.38
CECR2 Q9BXF3 2/20 0.38
BRD9 Q9H8M2 2/20 0.38
BRD7 Q9NPI1 2/20 0.38
CYP2D6 P10635 1/20 0.38
ACVR2B Q13705 1/20 0.38
BRD8 Q9H0E9 1/20 0.38
TNKS O95271 1/20 0.37
BRPF1 P55201 1/20 0.37
BPTF Q12830 1/20 0.37
TAF1L Q8IZX4 1/20 0.37
BAZ2B Q9UIF8 1/20 0.37
ATAD2B Q9ULI0 1/20 0.37

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
SCHEMBL245858 0.88 IDO1 (0.39) IDO1TGFBR1CYP1A2CYP3A4ACVR1
SCHEMBL3389923 0.87 GSK3B (0.40) IDO1TGFBR1CYP1A2CYP3A4
SCHEMBL3381872 0.86 HTR1A (0.38) IDO1TGFBR1CYP1A2CYP3A4ACVR1
SCHEMBL3385992 0.85 HTR6 (0.39) IDO1TGFBR1CYP1A2CYP3A4
SCHEMBL245797 0.84 CSNK2A2 (0.40) IDO1
SCHEMBL3380840 0.83 IDO1 (0.37) IDO1TGFBR1CYP1A2CYP3A4ACVR1
SCHEMBL21756156 0.81 TGFBR1 (0.39) IDO1TGFBR1CYP1A2CYP3A4ACVR1
SCHEMBL3389011 0.81 GSK3B (0.50) TGFBR1CYP1A2CYP3A4
SCHEMBL3390023 0.81 TGFBR1 (0.40) IDO1TGFBR1CYP1A2CYP3A4ACVR1
SCHEMBL3390252 0.81 TGFBR1 (0.40) IDO1TGFBR1CYP1A2CYP3A4TNKS

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
EP-2585461-B1 2,4-DIARYL-SUBSTITUTED [1,8]NAPHTHYRIDINES AS KINASE INHIBITORS FOR USE AGAINST CANCER MERCK PATENT GMBH (DE) 2020-02-26 EP disclosed
EP-2585461-B1 2,4-DIARYL-SUBSTITUTED [1,8]NAPHTHYRIDINES AS KINASE INHIBITORS FOR USE AGAINST CANCER MERCK PATENT GMBH (DE) 2020-02-26 EP disclosed
US-8791113-B2 2,4-diaryl-substituted [1,8] naphthyridines as kinase inhibitors for use against cancer MERCK PATENT GMBH (DE) 2014-07-29 US disclosed
US-8791113-B2 2,4-diaryl-substituted [1,8] naphthyridines as kinase inhibitors for use against cancer MERCK PATENT GMBH (DE) 2014-07-29 US disclosed
US-8791113-B2 2,4-diaryl-substituted [1,8] naphthyridines as kinase inhibitors for use against cancer MERCK PATENT GMBH (DE) 2014-07-29 US disclosed
US-20130102603-A1 2,4-DIARYL - SUBSTITUTED [1,8] NAPHTHYRIDINES AS KINASE INHIBITORS FOR USE AGAINST CANCER MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-04-25 US disclosed
US-20130102603-A1 2,4-DIARYL - SUBSTITUTED [1,8] NAPHTHYRIDINES AS KINASE INHIBITORS FOR USE AGAINST CANCER MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-04-25 US disclosed
US-20130102603-A1 2,4-DIARYL - SUBSTITUTED [1,8] NAPHTHYRIDINES AS KINASE INHIBITORS FOR USE AGAINST CANCER MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-04-25 US disclosed
WO-2012000595-A1 2,4- DIARYL - SUBSTITUTED [1,8] NAPHTHYRIDINES AS KINASE INHIBITORS FOR USE AGAINST CANCER MERCK PATENT GMBH (DE) 2012-01-05 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-20130102603-A1 2,4-DIARYL - SUBSTITUTED [1,8] NAPHTHYRIDINES AS KINASE INHIBITORS FOR USE AGAINST CANCER TGFBR1, TAB1, TGFBR2 IDO1 2183/4885BRD4 973/4885TGFBR1 1/4885

“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.