SCHEMBL11088154

SCHEMBL11088154

Clc1cccc(Nc2ncnc3cccc(Cl)c23)c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 15/20 0.68
FADS1 O60427 2/20 0.68
LCK P06239 2/20 0.66
KDM4E B2RXH2 3/20 0.59
MAPT P10636 3/20 0.59
ERBB2 P04626 2/20 0.59
MEN1 O00255 2/20 0.59
CYP1A2 P05177 2/20 0.59
CYP3A4 P08684 2/20 0.59
CYP2D6 P10635 2/20 0.59
KMT2A Q03164 2/20 0.59
NPC1 O15118 1/20 0.59
PRNP P04156 1/20 0.59
CYP2C9 P11712 1/20 0.59
CYP2C19 P33261 1/20 0.59
HTT P42858 1/20 0.59
ABL1 P00519 4/20 0.56
ABL2 P42684 3/20 0.56
SRC P12931 2/20 0.56
PDGFRB P09619 1/20 0.56

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
SCHEMBL31162309 1.00 EGFR (0.68) EGFRFADS1LCKKDM4EMAPT
Hydrochloric Acid SCHEMBL11091518 0.99 EGFR (0.68) EGFRFADS1LCKKDM4EMAPT
SCHEMBL11085630 0.86 EGFR (0.58) EGFRFADS1LCKKDM4EMAPT
Hydrochloric Acid SCHEMBL11079649 0.85 EGFR (0.57) EGFRFADS1LCKKDM4EERBB2
SCHEMBL136003 0.81 EGFR (1.00) EGFRFADS1LCKKDM4EMAPT
SCHEMBL29352479 0.81 EGFR (1.00) EGFRFADS1LCKKDM4EMAPT
Hydrochloric Acid SCHEMBL9017042 0.79 EGFR (1.00) EGFRFADS1LCKKDM4EMAPT
SCHEMBL4738912 0.78 EGFR (0.58) EGFRFADS1LCKKDM4EMAPT
SCHEMBL4355658 0.78 EGFR (1.00) EGFRFADS1LCKKDM4EMAPT
SCHEMBL4740533 0.78 EGFR (0.82) EGFRFADS1LCKKDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4464375-A ANALGESIC, ANTIINFLAMMATORY SANKYO CO., LTD. (JP) 1984-08-07 US disclosed
US-4322420-A Method of using 4-anilinoquinazoline derivatives as analgesic and anti-inflammatory agents SANKYO COMPANY LIMITED (JP) 1982-03-30 US disclosed