SCHEMBL9800595

SCHEMBL9800595

CCCCCCCCCCCCN(CCCCCCCCCCCC)c1[c]cccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 7/20 0.40
DNM1 Q05193 3/20 0.38
NPC1 O15118 1/20 0.36
JAK2 O60674 1/20 0.36
RAB9A P51151 1/20 0.36
PAX8 Q06710 1/20 0.36
ALDH1A1 P00352 2/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C19 P33261 1/20 0.35
ICMT O60725 1/20 0.35
ALB P02768 1/20 0.35
SIGMAR1 Q99720 1/20 0.34
DRD2 P14416 1/20 0.34
OPRM1 P35372 1/20 0.34
DRD3 P35462 1/20 0.34
OPRD1 P41143 1/20 0.34
OPRK1 P41145 1/20 0.34
TP53 P04637 1/20 0.34
CNR2 P34972 2/20 0.33

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
SCHEMBL8643073 1.00 KCNH2 (0.40) KCNH2DNM1NPC1JAK2RAB9A
SCHEMBL9800560 1.00 KCNH2 (0.40) KCNH2DNM1NPC1JAK2RAB9A
SCHEMBL2460597 1.00 KCNH2 (0.40) KCNH2DNM1NPC1JAK2RAB9A
SCHEMBL1077660 0.98 KCNH2 (0.38) KCNH2DNM1NPC1JAK2RAB9A
SCHEMBL2459640 0.93 KCNH2 (0.41) KCNH2DNM1NPC1JAK2RAB9A
SCHEMBL2460591 0.93 TDP1 (0.37) KCNH2ALDH1A1OPRM1CNR2
SCHEMBL4719826 0.89 TDP1 (0.35) KCNH2ALDH1A1SIGMAR1OPRM1
SCHEMBL2456294 0.86 MAPT (0.36) KCNH2ALDH1A1OPRM1
SCHEMBL816702 0.85 TP53 (0.34) KCNH2SIGMAR1DRD3TP53
SCHEMBL8152375 0.84 KCNH2 (0.35) KCNH2NPC1JAK2RAB9APAX8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0269573-B1 LIQUID PHOTOINITIATING MIXTURE CIBA-GEIGY AG (CH) 1991-03-27 EP disclosed
US-4960746-A A-HYDROXY-OR A-AMINO-ACETOPHENONES AND A TITANOCENE COMPOUND SUBSTITUTED BY FLUORINE CIBA-GEIGY CORPORATION (US) 1990-10-02 US disclosed
EP-0269573-A2 Liquid photoinitiating mixture CIBA-GEIGY AG (CH) 1988-06-01 EP disclosed
US-4652648-A STABILIZERS FOR HEAT, OXIDATION AND LIGHT CIBA-GEIGY CORPORATION (US) 1987-03-24 US disclosed
US-4579682-A HEAT, OXYGEN, AND LIGHT PROTECTION FOR POLYMERS CIBA-GEIGY CORPORATION (US) 1986-04-01 US disclosed
EP-0042359-B1 PHOSPHONOUS-ACID MONOESTER MONOAMIDE AND ORGANIC POLYMERS STABILIZED THEREWITH CIBA-GEIGY AG (CH) 1984-10-31 EP disclosed
US-4434109-A STABILIZERS AGAINST HEAT, OXYGEN AND LIGHT CIBA-GEIGY CORPORATION (US) 1984-02-28 US disclosed
EP-0042359-A1 Phosphonous-acid monoester monoamide and organic polymers stabilized therewith CIBA-GEIGY AG (CH) 1981-12-23 EP disclosed