SCHEMBL8565229

SCHEMBL8565229

c1cc2ccc3nnncc3c2[nH]1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
AHR P35869 1/20 0.37
TNF P01375 1/20 0.35
RIPK1 Q13546 1/20 0.35
PIM3 Q86V86 1/20 0.32
EGFR P00533 1/20 0.30
BRD4 O60885 1/20 0.30
TAF1 P21675 1/20 0.30
BRPF1 P55201 1/20 0.30
CREBBP Q92793 1/20 0.30
CECR2 Q9BXF3 1/20 0.30
BRD9 Q9H8M2 1/20 0.30
KEAP1 Q14145 1/20 0.30

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
SCHEMBL427782 0.80 AHR (0.36) AHR
SCHEMBL2150779 0.78 TNF (0.35) AHRTNFRIPK1PIM3EGFR
SCHEMBL3085133 0.74 KDM4A (0.33) PIM3
SCHEMBL450386 0.73 EGFR (0.40) AHRTNFRIPK1EGFR
Urea SCHEMBL1549376 0.73 CCNA2 (0.43)
SCHEMBL16896218 0.71 EGFR (0.39) AHRTNFRIPK1EGFR
SCHEMBL7744423 0.71 AHR (0.35) AHRTNFRIPK1PIM3
SCHEMBL4538052 0.70 AOC3 (0.32)
SCHEMBL1233929 0.69 CCNA2 (0.37)
SCHEMBL167198 0.69 CCNA2 (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0802198-A2 Pyridazino-, pyrimido, pyrazino and triazino-indoles BAYER AG (DE) 1997-10-22 EP claimed
US-20230183249-A1 NEW TRIAZINOINDOLE COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2023-06-15 US disclosed
EP-4143192-A1 NEW TRIAZINOINDOLE COMPOUNDS JANSSEN Pharmaceutica NV (BE) 2023-03-08 EP disclosed
EP-4143192-A1 NEW TRIAZINOINDOLE COMPOUNDS JANSSEN Pharmaceutica NV (BE) 2023-03-08 EP disclosed
WO-2023277341-A1 ANTIVIRAL AGENT INCLUDING TRIAZINOINDOLE DERIVATIVE AS ACTIVE INGREDIENT 재단법인 대구경북첨단의료산업진흥재단 2023-01-05 WO disclosed
WO-2023277341-A1 ANTIVIRAL AGENT INCLUDING TRIAZINOINDOLE DERIVATIVE AS ACTIVE INGREDIENT 재단법인 대구경북첨단의료산업진흥재단 2023-01-05 WO disclosed
WO-2023277341-A1 ANTIVIRAL AGENT INCLUDING TRIAZINOINDOLE DERIVATIVE AS ACTIVE INGREDIENT 재단법인 대구경북첨단의료산업진흥재단 2023-01-05 WO disclosed
CN-115485280-A Novel triazinoindole compounds 詹森药业有限公司 2022-12-16 CN disclosed
CN-115485280-A Novel triazinoindole compounds 詹森药业有限公司 2022-12-16 CN disclosed
US-20170079252-A1 NOVEL GERM CELL ABLATION COMPOUNDS AND USES THEREOF THE GENERAL HOSPITAL CORPORATION (US) 2017-03-23 US disclosed
US-9538734-B2 Germ cell ablation compounds and uses thereof THE GENERAL HOSPITAL CORPORATION (US) 2017-01-10 US disclosed
US-20140261212-A1 NOVEL GERM CELL ABLATION COMPOUNDS AND USES THEREOF THE GENERAL HOSPITAL CORPORATION (US) 2014-09-18 US disclosed
EP-0802198-A3 Pyridazino-, pyrimido, pyrazino and triazino-indoles BAYER AG (DE) 1998-04-15 EP disclosed
EP-0802198-A3 Pyridazino-, pyrimido, pyrazino and triazino-indoles BAYER AG (DE) 1998-04-15 EP disclosed
EP-0802198-A2 Pyridazino-, pyrimido, pyrazino and triazino-indoles BAYER AG (DE) 1997-10-22 EP disclosed
EP-0802198-A2 Pyridazino-, pyrimido, pyrazino and triazino-indoles BAYER AG (DE) 1997-10-22 EP disclosed
EP-0802198-A2 Pyridazino-, pyrimido, pyrazino and triazino-indoles BAYER AG (DE) 1997-10-22 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-20170079252-A1 NOVEL GERM CELL ABLATION COMPOUNDS AND USES THEREOF ALPG, PROX1, SOX18 AHR 2160/4885TNF 4804/4885RIPK1 2543/4885
US-20230183249-A1 NEW TRIAZINOINDOLE COMPOUNDS NLRP3, NLRP1, PYCARD AHR 1496/4885TNF 537/4885RIPK1 138/4885

“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.