SCHEMBL9149405

SCHEMBL9149405

O=C(Nc1cccc(C(=O)O)c1O)Oc1cccc(-c2ccccc2)c1

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
ALOX15 P16050 1/20 0.49
MAPK1 P28482 1/20 0.49
HSD17B10 Q99714 1/20 0.49
KDM4E B2RXH2 2/20 0.49
ALDH1A1 P00352 2/20 0.49
LMNA P02545 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
TRPV1 Q8NER1 1/20 0.48
FAAH O00519 1/20 0.48
MAPT P10636 1/20 0.48
HCAR2 Q8TDS4 1/20 0.47

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
SCHEMBL8657491 0.89 ALDH1A1 (0.56) NPC1RAB9ANPSR1ALOX15MAPK1
SCHEMBL9150577 0.84 KMT2A (0.54) NPC1RAB9ANPSR1ALOX15MAPK1
SCHEMBL9149565 0.84 KDM4E (0.61) NPC1RAB9ANPSR1ALOX15MAPK1
SCHEMBL9153663 0.84 KDM4E (0.51) NPC1RAB9ANPSR1ALOX15MAPK1
SCHEMBL9150490 0.81 TRPV1 (0.52) NPC1RAB9ANPSR1ALOX15MAPK1
SCHEMBL9151490 0.80 KDM4E (0.47) NPC1RAB9ANPSR1ALOX15MAPK1
SCHEMBL9148439 0.79 KDM4E (0.49) KDM4EALDH1A1LMNASMN1; SMN2MEN1
SCHEMBL8658139 0.78 KMT2A (0.51) NPC1RAB9AALOX15MAPK1HSD17B10
SCHEMBL9147100 0.78 HSD17B10 (0.48) ALOX15MAPK1HSD17B10KDM4EALDH1A1
SCHEMBL8657664 0.78 HSD17B10 (0.51) ALOX15MAPK1HSD17B10KDM4EALDH1A1

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
US-5476957-A Dye for heat sensitive recording MITSUI TOATSU CHEMICALS, INC. (JP) 1995-12-19 US disclosed
US-5346878-A Preservation stability of white portions and images MITSUI TOATSU CHEMICALS, INC. (JP) 1994-09-13 US disclosed
US-5306688-A Color-forming, electron donating compound and electron accepting compound; storage stability of uncolored portion MITSUI TOATSU CHEMICALS, INC. (JP) 1994-04-26 US disclosed