SCHEMBL6425545

SCHEMBL6425545

c1ccc(CCOc2ccc3ccccc3c2)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.67
KDM4E B2RXH2 2/20 0.63
MAPK1 P28482 1/20 0.63
TDP1 Q9NUW8 1/20 0.63
PPARG P37231 1/20 0.63
NPC1 O15118 2/20 0.59
RAB9A P51151 2/20 0.59
MAOA P21397 3/20 0.57
MAOB P27338 3/20 0.57
AGXT P21549 2/20 0.55
MAPT P10636 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
PTPN7 P35236 1/20 0.53
FFAR1 O14842 1/20 0.53
SLC16A3 O15427 1/20 0.52
LTA4H P09960 1/20 0.51
CA12 O43570 1/20 0.51
CA1 P00915 1/20 0.51
CA2 P00918 1/20 0.51
CA7 P43166 1/20 0.51

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
SCHEMBL8397859 0.86 NPC1 (0.53) ALOX5KDM4EMAPK1TDP1PPARG
SCHEMBL16902851 0.83 TDP1 (0.87) ALOX5KDM4EMAPK1TDP1PPARG
SCHEMBL9456979 0.83 NPC1 (0.80) NPC1RAB9AMAOAMAOBFFAR1
SCHEMBL19820253 0.83 KDM4E (0.53) ALOX5KDM4EMAPK1TDP1PPARG
SCHEMBL5701143 0.82 PPARG (0.68) ALOX5KDM4EMAPK1TDP1PPARG
SCHEMBL5701236 0.82 DRD2 (0.71) ALOX5KDM4EMAPK1TDP1PPARG
SCHEMBL2177291 0.82 KDM4E (0.77) ALOX5KDM4EMAPK1TDP1PPARG
SCHEMBL17912866 0.82 NPC1 (0.60) NPC1RAB9AMAOAMAOBFFAR1
SCHEMBL29429997 0.81 TDP1 (0.76) ALOX5KDM4EMAPK1TDP1PPARG
SCHEMBL1859481 0.81 TDP1 (0.76) ALOX5KDM4EMAPK1TDP1PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107722068-B Tridentate nitrogen phosphine ligand and complex thereof, and application of tridentate nitrogen phosphine ligand and complex thereof in asymmetric catalytic hydrogenation of ketone 凯特立斯(深圳)科技有限公司 2020-05-22 CN disclosed
CN-104837948-A Heat activated pressure sensitive adhesive ROHM & HAAS 2015-08-12 CN disclosed
EP-1193284-B1 Heat-sensitive adhesive material,method of preparing same and method of using same RICOH KK (JP) 2005-03-23 EP disclosed
US-6828017-B2 Thermoplastic resin, a solid plasticizer, and a supercooling improving agent; non-adhesive at ambient temperature but becomes and remains adhesive upon and after being thermally activated. RICOH COMPANY, LTD. (JP) 2004-12-07 US disclosed
US-20020064613-A1 Heat-sensitive adhesive material, method of preparing same and method of using same RICOH COMPANY, LTD. 2002-05-30 US disclosed
EP-1193284-A1 Heat-sensitive adhesive material,method of preparing same and method of using same Ricoh Company (JP) 2002-04-03 EP disclosed