SCHEMBL4430442

SCHEMBL4430442

COc1cc2ncnc(N)c2cc1OCCCN1CCCCC1

nearest known ligand 0.69

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EHMT2 Q96KQ7 7/20 0.69
EHMT1 Q9H9B1 7/20 0.69
SPIN1 Q9Y657 3/20 0.64
TLR9 Q9NR96 1/20 0.61
TLR7 Q9NYK1 1/20 0.61
KIT P10721 2/20 0.60
KDR P35968 2/20 0.58
EGFR P00533 3/20 0.58
ABCB11 O95342 1/20 0.56
PDPK1 O15530 1/20 0.56
RET P07949 1/20 0.56
KIF5B P33176 1/20 0.56
FGFR1 P11362 1/20 0.55
FLT1 P17948 1/20 0.55
FLT4 P35916 1/20 0.55

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
SCHEMBL4431962 1.00 EHMT2 (0.69) EHMT2EHMT1SPIN1TLR9TLR7
SCHEMBL4426202 0.99 EHMT2 (0.70) EHMT2EHMT1SPIN1TLR9TLR7
SCHEMBL4427357 0.94 EHMT2 (0.60) EHMT2EHMT1SPIN1TLR9TLR7
SCHEMBL4431419 0.93 EHMT2 (0.61) EHMT2EHMT1SPIN1TLR9TLR7
SCHEMBL4419423 0.93 EHMT2 (0.61) EHMT2EHMT1SPIN1TLR9TLR7
SCHEMBL4423943 0.91 EHMT2 (0.59) EHMT2EHMT1SPIN1TLR9TLR7
SCHEMBL4428694 0.89 SRC (0.65) KITKDREGFRABCB11RET
SCHEMBL29540227 0.89 SRC (0.65) KITKDREGFRABCB11RET
SCHEMBL4422710 0.89 SRC (0.65) KITKDREGFRABCB11RET
SCHEMBL2475406 0.87 EHMT2 (0.64) EHMT2EHMT1SPIN1TLR9TLR7

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
US-7498335-B2 Method of producing an antiangiogenic or vascular permeability reducing effect ASTRAZENECA AB (CH) 2009-03-03 US disclosed
EP-1218353-B1 QUINAZOLINE DERIVATIVES ASTRAZENECA UK LTD (GB) 2007-10-17 EP 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
EP-1272185-A2 USE OF QUINAZOLINE DERIVATIVES AS ANGIOGENESIS INHIBITORS AstraZeneca AB (SE) 2003-01-08 EP disclosed
EP-1218353-A1 QUINAZOLINE DERIVATIVES AstraZeneca UK Limited (GB) 2002-07-03 EP disclosed
WO-2002002534-A1 QUINAZOLINES WITH THERAPEUTIC USE ASTRAZENECA AB (SE) 2002-01-10 WO disclosed
WO-2001066099-A2 USE OF QUINAZOLINE DERIVATIVES AS ANGIOGENESIS INHIBITORS ASTRAZENECA AB (SE) 2001-09-13 WO disclosed
WO-2001004102-A1 QUINAZOLINE DERIVATIVES ASTRAZENECA UK LIMITED (GB) 2001-01-18 WO disclosed