SCHEMBL5652410

SCHEMBL5652410

Nc1ccc(OCc2ccc(F)cc2Cl)nc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
RAB9A P51151 1/20 0.43
ALOX15 P16050 2/20 0.42
HSD17B10 Q99714 2/20 0.42
ALDH1A1 P00352 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
POLB P06746 1/20 0.42
INPPL1 O15357 2/20 0.40
CRHBP P24387 1/20 0.39
CRHR2 Q13324 1/20 0.39
HTR2C P28335 2/20 0.39
SLC6A4 P31645 2/20 0.39
CYP1A2 P05177 2/20 0.38
CYP3A4 P08684 2/20 0.38
CYP2C9 P11712 2/20 0.38
CYP2C19 P33261 2/20 0.38
PTGER1 P34995 2/20 0.38

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
SCHEMBL5650346 0.79 IDO1 (0.49) KDM4EMEN1KMT2APOLB
SCHEMBL5921916 0.79 RAB9A (0.56) MEN1KMT2ARAB9AALOX15HSD17B10
SCHEMBL5650853 0.77 RAB9A (0.41) MEN1KMT2ARAB9AALOX15HSD17B10
SCHEMBL21186229 0.77 KMT2A (0.59) KDM4EMEN1KMT2ARAB9AHSD17B10
SCHEMBL26128621 0.75 DHFR (0.44) MEN1KMT2ARAB9AALOX15HSD17B10
SCHEMBL3365264 0.75 MEN1 (0.60) KDM4EMEN1KMT2A
SCHEMBL5650279 0.74 NPC1 (0.44) KDM4EMEN1KMT2ARAB9AALDH1A1
SCHEMBL4415791 0.74 MAOB (0.63) KDM4EMEN1KMT2AGRM5
SCHEMBL5321349 0.73 ALOX15 (0.53) KDM4ERAB9AALOX15HSD17B10ALDH1A1
SCHEMBL4638512 0.72 MAOB (0.50) MEN1KMT2ARAB9AALOX15HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7235559-B1 Therapeutic quinazoline derivatives ASTRAZENECA AB (SE) 2007-06-26 US disclosed
EP-1218355-A1 THERAPEUTIC QUINAZOLINE DERIVATIVES AstraZeneca AB (SE) 2002-07-03 EP disclosed
WO-2001021597-A1 THERAPEUTIC QUINAZOLINE DERIVATIVES ASTRAZENECA AB (SE) 2001-03-29 WO disclosed