SCHEMBL9867682

SCHEMBL9867682

Oc1cccc(C=Cc2ccc3ccccc3n2)c1O

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ECE2 P0DPD6 3/20 0.79
NPC1 O15118 10/20 0.60
RAB9A P51151 9/20 0.60
SMN1; SMN2 Q16637 3/20 0.60
L3MBTL1 Q9Y468 2/20 0.60
PKM P14618 2/20 0.60
NFKB1 P19838 1/20 0.60
NFKB2 Q00653 1/20 0.60
RELA Q04206 1/20 0.60
MEN1 O00255 7/20 0.56
KMT2A Q03164 7/20 0.56
KDM4E B2RXH2 6/20 0.56
LMNA P02545 5/20 0.56
MAPT P10636 4/20 0.56
ALDH1A1 P00352 2/20 0.56
CYSLTR2 Q9NS75 1/20 0.56
CYSLTR1 Q9Y271 1/20 0.56
PIM1 P11309 1/20 0.56
HSP90AA1 P07900 2/20 0.54
AGTR1 P30556 1/20 0.54

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
SCHEMBL9867671 1.00 ECE2 (0.79) ECE2NPC1RAB9ASMN1; SMN2L3MBTL1
SCHEMBL10325190 0.89 ECE2 (1.00) ECE2NPC1RAB9ASMN1; SMN2L3MBTL1
SCHEMBL15549880 0.89 ECE2 (1.00) ECE2NPC1RAB9ASMN1; SMN2L3MBTL1
SCHEMBL10325191 0.89 ECE2 (1.00) ECE2NPC1RAB9ASMN1; SMN2L3MBTL1
SCHEMBL31060773 0.89 ECE2 (1.00) ECE2NPC1RAB9ASMN1; SMN2L3MBTL1
SCHEMBL30163114 0.89 ECE2 (1.00) ECE2NPC1RAB9ASMN1; SMN2L3MBTL1
Hydrochloric Acid SCHEMBL15550704 0.87 ECE2 (0.97) ECE2NPC1RAB9ASMN1; SMN2L3MBTL1
Hydrochloric Acid SCHEMBL15550705 0.87 ECE2 (0.97) ECE2NPC1RAB9ASMN1; SMN2L3MBTL1
SCHEMBL4881278 0.81 ECE2 (0.83) ECE2NPC1RAB9ASMN1; SMN2L3MBTL1
SCHEMBL28443608 0.79 RAB9A (0.80) ECE2NPC1RAB9ASMN1; SMN2L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0256180-B1 CHROMOGENIC COMPOUNDS FOR PRESSURE- OR HEAT-SENSITIVE RECORDING PAPERS YAMADA CHEMICAL CO., LTD. (JP) 1989-12-27 EP claimed
EP-0256180-A1 Chromogenic compounds for pressure- or heat-sensitive recording papers YAMADA CHEMICAL CO., LTD. (JP) 1988-02-24 EP claimed
US-5071987-A Quinoline dyes; colorfastness BASF AKTIENGESELLSCHAFT (DE) 1991-12-10 US disclosed
EP-0256180-B1 CHROMOGENIC COMPOUNDS FOR PRESSURE- OR HEAT-SENSITIVE RECORDING PAPERS YAMADA CHEMICAL CO., LTD. (JP) 1989-12-27 EP disclosed