SCHEMBL5649684

SCHEMBL5649684

Cc1cc(N)cnc1OCc1ccc(Cl)cc1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP17A1 P05093 1/20 0.43
LMNA P02545 1/20 0.42
MAPT P10636 1/20 0.42
HTT P42858 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
MAOB P27338 4/20 0.41
IDO1 P14902 2/20 0.41
AGXT P21549 2/20 0.41
DHFR P00374 1/20 0.40
HTR6 P50406 1/20 0.40
MPO P05164 1/20 0.39
TEC P42680 1/20 0.39
APP P05067 1/20 0.38
POLB P06746 2/20 0.38
CCR5 P51681 1/20 0.38
HRH4 Q9H3N8 1/20 0.37

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
SCHEMBL5652395 0.88 PIN1 (0.45) MAPTMAOBAGXTMPOHRH4
SCHEMBL5651640 0.85 MAOB (0.49) LMNAMAPTHTTSMN1; SMN2MAOB
SCHEMBL5648620 0.84 L3MBTL1 (0.47) LMNAMAPTHTTSMN1; SMN2L3MBTL1
SCHEMBL5655538 0.84 KDM4E (0.54) MAPTMAOBIDO1AGXTDHFR
SCHEMBL18072325 0.76 NUDT1 (0.53) CYP17A1LMNAMAPTHTTSMN1; SMN2
SCHEMBL4061661 0.74 CYP1A2 (0.52) SMN1; SMN2L3MBTL1POLB
SCHEMBL5650853 0.73 RAB9A (0.41) LMNAHTTSMN1; SMN2L3MBTL1POLB
SCHEMBL3378270 0.73 TSHR (0.38) MAPTL3MBTL1POLB
SCHEMBL7539477 0.72 SYK (0.49) L3MBTL1HRH4
SCHEMBL4323959 0.71 MAOB (0.54) MAOBIDO1AGXTDHFRTEC

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 4 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
CN-1391563-A Therapeutic quinazoline derivatives ASTRAZENECA AB (SE) 2003-01-15 CN 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