SCHEMBL4416618

SCHEMBL4416618

O=c1ccc2cc3ncn[c]c3cc2[nH]1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 5/20 0.42
CA12 O43570 2/20 0.39
CA9 Q16790 2/20 0.39
F11 P03951 1/20 0.39
CA1 P00915 1/20 0.36
CA3 P07451 1/20 0.36
CA4 P22748 1/20 0.36
CA6 P23280 1/20 0.36
CA5A P35218 1/20 0.36
CA7 P43166 1/20 0.36
CA13 Q8N1Q1 1/20 0.36
CA14 Q9ULX7 1/20 0.36
CA5B Q9Y2D0 1/20 0.36
PDE3B Q13370 4/20 0.36
PDE3A Q14432 4/20 0.36
AR P10275 1/20 0.33
TBXAS1 P24557 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
PIK3CD O00329 1/20 0.31

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
SCHEMBL4421090 0.74 MAPKAPK2 (0.44) MAPKAPK2RPS6KA3CSNK2A1PLK3
SCHEMBL5738855 0.72 MAPK1 (0.50) MAPK1CA12CA9F11CA1
SCHEMBL5828085 0.70 CHEK1 (0.42) MAPK1MEN1KMT2AEGFRCSNK2A1
SCHEMBL4422632 0.70 KMO (0.44) PDE3BPDE3APOLB
SCHEMBL4427818 0.70 CMA1 (0.38) PDE3BPDE3A
SCHEMBL17511896 0.70 PI4KA (0.43) KMT2APIK3CDEGFRPIK3CA
SCHEMBL17951770 0.68 MAPK1 (0.68) MAPK1CA12CA9F11CA1
SCHEMBL10423740 0.68 MAPK1 (0.50) MAPK1CA12CA9F11CA1
SCHEMBL4427247 0.68 MAPK1 (0.46) MAPK1CA12CA9F11CA1
SCHEMBL4420255 0.68 LMNA (0.45) PDE3BPDE3AMEN1KMT2ARXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0635507-B1 Tricyclic derivatives and their use as anti-cancer agents ZENECA LTD (GB) 1999-09-15 EP claimed
US-5569658-A Tricyclic derivatives ZENECA LIMITED (GB) 1996-10-29 US claimed
EP-0635507-A1 Tricyclic derivatives and their use as anti-cancer agents ZENECA LIMITED (GB) 1995-01-25 EP claimed
US-7498335-B2 Method of producing an antiangiogenic or vascular permeability reducing effect ASTRAZENECA AB (CH) 2009-03-03 US disclosed
US-7001904-B1 Guanidine derivatives quinazoline and quinoline for use in the treatment of autoimmune diseases ASTRAZENECA AB (SE) 2006-02-21 US disclosed
EP-1272185-B1 USE OF QUINAZOLINE DERIVATIVES AS ANGIOGENESIS INHIBITORS ASTRAZENECA AB (SE) 2005-07-27 EP disclosed
US-6806274-B1 IMMUNOREGULATION OR IMMUNOSUPPRESSIVE AGENTS; TYROSINE KINASE INHIBITORS; PREVENTING ORGAN TRANSPLANT REJECTION; AUTOIMMUNE CONDITIONS; REDUCED SIDE EFFECTS ASTRAZENECA UK LIMITED (GB) 2004-10-19 US disclosed
US-20030225111-A1 Therapy ASTRAZENECA AB (SE) 2003-12-04 US disclosed
EP-1296973-A1 GUANIDINE DERIVATIVES OF QUINAZOLINE AND QUINOLINE FOR USE IN THE TREATMENT OF AUTOIMMUNE DISEASES AstraZeneca AB (SE) 2003-04-02 EP disclosed
WO-2002000644-A1 GUANIDINE DERIVATIVES OF QUINAZOLINE AND QUINOLINE FOR USE IN THE TREATMENT OF AUTOIMMUNE DISEASES ASTRAZENECA AB (SE) 2002-01-03 WO disclosed
EP-0635507-B1 Tricyclic derivatives and their use as anti-cancer agents ZENECA LTD (GB) 1999-09-15 EP disclosed
US-5569658-A Tricyclic derivatives ZENECA LIMITED (GB) 1996-10-29 US disclosed
EP-0635507-A1 Tricyclic derivatives and their use as anti-cancer agents ZENECA LIMITED (GB) 1995-01-25 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 (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-20030225111-A1 Therapy VEGFA, AQP1, FLT1 MAPK1 813/4885CA12 1090/4885CA9 371/4885

“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.