SCHEMBL9150490

SCHEMBL9150490

O=C(Nc1cccc(C(=O)O)c1O)Oc1ccc(O)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.52
KDM4E B2RXH2 7/20 0.50
ALDH1A1 P00352 6/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
LMNA P02545 1/20 0.50
CYP1A2 P05177 1/20 0.50
HPGD P15428 1/20 0.50
KMT2A Q03164 4/20 0.47
MEN1 O00255 3/20 0.47
MAPT P10636 4/20 0.47
GAA P10253 3/20 0.47
GLA P06280 1/20 0.47
THRB P10828 1/20 0.47
BLM P54132 1/20 0.47
CASP6 P55212 1/20 0.47
GFER P55789 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
CASR P41180 1/20 0.45
HSD17B10 Q99714 2/20 0.44
ALOX15 P16050 1/20 0.44

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 0.91 ALDH1A1 (0.56) TRPV1KDM4EALDH1A1SMN1; SMN2LMNA
SCHEMBL9147813 0.89 KDM4E (0.61) TRPV1KDM4EALDH1A1SMN1; SMN2LMNA
SCHEMBL9153663 0.89 KDM4E (0.51) TRPV1KDM4EALDH1A1SMN1; SMN2LMNA
SCHEMBL8657664 0.89 HSD17B10 (0.51) TRPV1KDM4EALDH1A1SMN1; SMN2LMNA
SCHEMBL8654528 0.89 ALDH1A1 (0.56) TRPV1KDM4EALDH1A1SMN1; SMN2LMNA
SCHEMBL8658139 0.89 KMT2A (0.51) TRPV1KDM4EALDH1A1SMN1; SMN2LMNA
SCHEMBL9147100 0.89 HSD17B10 (0.48) TRPV1KDM4EALDH1A1SMN1; SMN2LMNA
SCHEMBL9148439 0.86 KDM4E (0.49) TRPV1KDM4EALDH1A1SMN1; SMN2LMNA
SCHEMBL9153561 0.86 ALDH1A1 (0.46) TRPV1KDM4EALDH1A1SMN1; SMN2LMNA
SCHEMBL9150613 0.86 SMN1; SMN2 (0.55) KDM4EALDH1A1SMN1; SMN2LMNACYP1A2

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