SCHEMBL4015486

SCHEMBL4015486

c1ccc(-c2cccc(-n3cnc4ccccc43)c2)cc1

nearest known ligand 0.71

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.71
FGFR1 P11362 7/20 0.67
CYP11B1 P15538 1/20 0.54
CYP11B2 P19099 1/20 0.54
KDR P35968 1/20 0.54
MAPT P10636 1/20 0.52
KMT2A Q03164 1/20 0.52
PTK2B Q14289 1/20 0.52
NPSR1 Q6W5P4 1/20 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
SCHEMBL2641988 0.90 FGFR1 (0.59) HTTFGFR1KDRMAPTKMT2A
SCHEMBL20180561 0.88 HTT (0.59) HTTFGFR1MAPTKMT2APTK2B
SCHEMBL16158540 0.88 FGFR1 (0.83) HTTFGFR1
SCHEMBL2642001 0.88 FGFR1 (0.83) HTTFGFR1
SCHEMBL2642019 0.88 FGFR1 (0.60) HTTFGFR1
SCHEMBL3417304 0.88 HTT (0.78) HTTFGFR1
SCHEMBL16158486 0.86 FGFR1 (0.59) HTTFGFR1KDRMAPTKMT2A
SCHEMBL13045092 0.85 FGFR1 (0.57) HTTFGFR1MAPTKMT2APTK2B
SCHEMBL23266576 0.84 FGFR1 (0.60) HTTFGFR1
SCHEMBL18731746 0.84 HTT (0.79) HTTFGFR1MAPTKMT2APTK2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040077634-A1 Treatment of diseases characterized by excessive or insufficient cell death NEUROSEARCH A/S (DK) 2004-04-22 US claimed
EP-1361874-A1 TREATMENT OF DISEASES CHARACTERIZED BY EXCESSIVE OR INSUFFICIENT CELL DEATH NEUROSEARCH A/S (DK) 2003-11-19 EP claimed
WO-2002064128-A1 TREATMENT OF DISEASES CHARACTERIZED BY EXCESSIVE OR INSUFFICIENT CELL DEATH NEUROSEARCH A/S (DK) 2002-08-22 WO claimed
US-20230312612-A1 HETEROAROMATIC COMPOUNDS FOR ORGANIC ELECTROLUMINESCENT DEVICES UDC IRELAND LIMITED (IE) 2023-10-05 US disclosed
WO-2022002772-A1 HETEROAROMATIC COMPOUNDS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2022-01-06 WO disclosed
US-7534505-B2 Organometallic compounds for use in electroluminescent devices THE UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2009-05-19 US disclosed
WO-2005113704-A2 LUMINESCENT COMPOUNDS WITH CARBENE LIGANDS THE UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2005-12-01 WO disclosed
US-20050260448-A1 Novel organometallic compounds for use in electroluminescent devices UNIVERSAL DISPLAY CORPORATION 2005-11-24 US disclosed
US-20040077634-A1 Treatment of diseases characterized by excessive or insufficient cell death NEUROSEARCH A/S (DK) 2004-04-22 US disclosed
EP-1361874-A1 TREATMENT OF DISEASES CHARACTERIZED BY EXCESSIVE OR INSUFFICIENT CELL DEATH NEUROSEARCH A/S (DK) 2003-11-19 EP disclosed
WO-2002064128-A1 TREATMENT OF DISEASES CHARACTERIZED BY EXCESSIVE OR INSUFFICIENT CELL DEATH NEUROSEARCH A/S (DK) 2002-08-22 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 (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-20040077634-A1 Treatment of diseases characterized by excessive or insufficient cell death APAF1, CASP9, AIFM1 HTT 266/4885FGFR1 4070/4885CYP11B1 569/4885
US-20230312612-A1 HETEROAROMATIC COMPOUNDS FOR ORGANIC ELECTROLUMINESCENT DEVICES DDT, EED, CTCF HTT 191/4885FGFR1 4356/4885CYP11B1 733/4885

“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.