SCHEMBL7810189

SCHEMBL7810189

CC1c2ccccc2CCN1c1nc(N(C)c2ccccc2)nc2ccccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EHMT2 Q96KQ7 1/20 0.38
EHMT1 Q9H9B1 1/20 0.38
MERTK Q12866 2/20 0.37
AURKA O14965 1/20 0.36
SRC P12931 1/20 0.36
GSK3B P49841 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
MAPT P10636 3/20 0.35
ALDH1A1 P00352 2/20 0.35
CYP3A4 P08684 2/20 0.35
CYP2D6 P10635 2/20 0.35
TSHR P16473 2/20 0.35
MAPK1 P28482 2/20 0.35
KDM4E B2RXH2 1/20 0.35
TP53 P04637 1/20 0.35
HPGD P15428 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HSD17B10 Q99714 1/20 0.35

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
Hydrochloric Acid SCHEMBL7819979 0.99 EHMT2 (0.38) EHMT2EHMT1MERTKAURKASRC
SCHEMBL6991158 0.84 L3MBTL1 (0.36) EHMT2EHMT1L3MBTL1NPC1RAB9A
SCHEMBL7818490 0.84 EHMT2 (0.40) EHMT2EHMT1NPC1RAB9AMAPT
Hydrochloric Acid SCHEMBL6999560 0.83 L3MBTL1 (0.36) EHMT2EHMT1L3MBTL1NPC1RAB9A
Hydrochloric Acid SCHEMBL6990607 0.83 L3MBTL1 (0.36) EHMT2EHMT1L3MBTL1NPC1RAB9A
Hydrochloric Acid SCHEMBL6990610 0.83 L3MBTL1 (0.36) EHMT2EHMT1L3MBTL1NPC1RAB9A
Hydrochloric Acid SCHEMBL7810172 0.83 EHMT2 (0.39) EHMT2EHMT1NPC1RAB9AMAPT
SCHEMBL7824698 0.81 EGFR (0.43) MAPTALDH1A1CYP3A4CYP2D6TSHR
Hydrochloric Acid SCHEMBL6997882 0.81 NPC1 (0.36) L3MBTL1NPC1RAB9AMAPTALDH1A1
Hydrochloric Acid SCHEMBL6994238 0.80 L3MBTL1 (0.36) EHMT2EHMT1L3MBTL1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0677049-B1 QUINAZOLINE DERIVATIVES YUHAN CORP LTD (KR) 2001-07-25 EP claimed
EP-0677049-B1 QUINAZOLINE DERIVATIVES YUHAN CORP LTD (KR) 2001-07-25 EP disclosed
US-5686458-A Quinazoline deriviates for treating peptic ulcer YUHAN CORPORATION (KR) 1997-11-11 US disclosed
EP-0677049-A1 QUINAZOLINE DERIVATIVES YUHAN CORPORATION, LTD. (KR) 1995-10-18 EP disclosed
WO-1994014795-A1 QUINAZOLINE DERIVATIVES YUHAN CORPORATION (KR) 1994-07-07 WO disclosed