SCHEMBL16622251

SCHEMBL16622251

Cc1ccccc1-c1cnc(-c2ccccc2)cn1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.49
RAB9A P51151 3/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
PDGFRB P09619 1/20 0.49
KDR P35968 1/20 0.49
FLT3 P36888 1/20 0.49
ALOX5AP P20292 2/20 0.48
FEN1 P39748 2/20 0.48
IDO1 P14902 1/20 0.47
METAP2 P50579 1/20 0.47
ENPP3 O14638 1/20 0.46
ENPP1 P22413 1/20 0.46
LDHA P00338 1/20 0.46
ALDH1A1 P00352 4/20 0.46
TSHR P16473 3/20 0.46
HPGD P15428 2/20 0.46
CYP11B1 P15538 1/20 0.43
CYP11B2 P19099 1/20 0.43
CYP1A2 P05177 3/20 0.42
CYP2D6 P10635 3/20 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
SCHEMBL3424160 0.89 IDO1 (0.55) NPC1RAB9ASMN1; SMN2ALOX5APFEN1
SCHEMBL16948797 0.82 LDHA (0.49) NPC1RAB9ASMN1; SMN2PDGFRBKDR
SCHEMBL12186161 0.82 CYP1A2 (0.49) NPC1RAB9ASMN1; SMN2ALOX5APFEN1
SCHEMBL16526672 0.81 IDO1 (0.44) NPC1RAB9ASMN1; SMN2KDRALOX5AP
SCHEMBL25543839 0.81 CYP1A2 (0.47) NPC1RAB9ASMN1; SMN2PDGFRBKDR
SCHEMBL2187799 0.81 ENPP3 (0.51) NPC1RAB9ASMN1; SMN2PDGFRBKDR
SCHEMBL1304066 0.80 RAB9A (0.52) NPC1RAB9ASMN1; SMN2PDGFRBKDR
SCHEMBL16716060 0.79 LDHA (0.50) NPC1RAB9ASMN1; SMN2PDGFRBKDR
SCHEMBL28107573 0.78 FEN1 (0.66) ALOX5APFEN1
SCHEMBL16750238 0.78 CKS1B (0.49) NPC1RAB9ASMN1; SMN2PDGFRBKDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8999520-B2 Organometallic complex and light emitting element, light emitting device, and electronic device using the organometallic complex SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2015-04-07 US disclosed