SCHEMBL3920685

SCHEMBL3920685

Nc1ccc2oc(N)cc2c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 1/20 0.59
CA2 P00918 2/20 0.55
NPC1 O15118 5/20 0.49
RAB9A P51151 4/20 0.43
MAPT P10636 4/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
GFER P55789 2/20 0.43
APP P05067 3/20 0.43
CHRM2 P08172 1/20 0.42
CHRM4 P08173 1/20 0.42
CHRM5 P08912 1/20 0.42
CHRM1 P11229 1/20 0.42
CHRM3 P20309 1/20 0.42
DRD2 P14416 1/20 0.42
MAOA P21397 1/20 0.42
ALDH1A1 P00352 5/20 0.42
KDM4E B2RXH2 3/20 0.42
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
HPGD P15428 2/20 0.42

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
SCHEMBL9018982 0.81 CA2 (0.55) FLT3CA2NPC1RAB9AMAPT
SCHEMBL9812779 0.79 APP (0.57) CA2NPC1RAB9AMAPTSMN1; SMN2
SCHEMBL12347 0.77 ALDH1A1 (0.52) CA2SMN1; SMN2MAOAALDH1A1CYP3A4
SCHEMBL14941118 0.77 PIM1 (0.56) CA2NPC1RAB9AMAPTSMN1; SMN2
SCHEMBL15031527 0.77 MAOB (0.55) CA2NPC1RAB9AMAPTSMN1; SMN2
SCHEMBL12778679 0.77 FLT3 (0.55) FLT3CA2NPC1RAB9AMAPT
SCHEMBL19794945 0.77 CA2 (0.50) FLT3CA2NPC1APPCHRM2
SCHEMBL2790760 0.77 DYRK1A (0.59) FLT3CA2NPC1RAB9AMAPT
Hydrochloric Acid SCHEMBL2482195 0.76 DYRK1A (0.58) FLT3CA2NPC1RAB9AMAPT
SCHEMBL3277732 0.74 SMN1; SMN2 (0.63) FLT3CA2NPC1RAB9AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3049420-B1 THIENO[2,3-E]INDOLE DERIVATIVES AS NEW ANTITUMOR AGENTS NERVIANO MEDICAL SCIENCES SRL (IT) 2019-05-15 EP disclosed
US-7537812-B2 Aligning agent for liquid crystal and liquid-crystal alignment film obtained with the same NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2009-05-26 US disclosed
US-20070036915-A1 Comprising at least one polymer selected from a polyamic acid and a soluble polyimide, diethylene glycol diethyl ether, and dipropylene glycol monomethyl ether; good coating film uniformity even when the drying temperature changes during formation of the coating film MARIKO KUROSAKI ET AL 2007-02-15 US disclosed