SCHEMBL29688181

SCHEMBL29688181

Cc1cc(Cc2ccccc2)cc(C(=O)O)c1O

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HMGB1 P09429 2/20 0.83
CXCL12 P48061 2/20 0.83
PTPN1 P18031 8/20 0.69
PTPN2 P17706 3/20 0.69
PTPN6 P29350 3/20 0.69
HNF4A P41235 1/20 0.58
KDM4E B2RXH2 1/20 0.49
ALDH1A1 P00352 1/20 0.49
HPGD P15428 1/20 0.49
HSD17B10 Q99714 1/20 0.49
ACMSD Q8TDX5 1/20 0.48
KLKB1 P03952 1/20 0.47
CTSB P07858 1/20 0.47
MMP9 P14780 1/20 0.47
DNMT1 P26358 1/20 0.47
DNMT3B Q9UBC3 1/20 0.47
DNMT3L Q9UJW3 1/20 0.47
DNMT3A Q9Y6K1 1/20 0.47
LDHA P00338 1/20 0.47
LDHB P07195 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
SCHEMBL1129138 1.00 HMGB1 (0.83) HMGB1CXCL12PTPN1PTPN2PTPN6
SCHEMBL9755153 0.91 HMGB1 (1.00) HMGB1CXCL12PTPN1PTPN2PTPN6
SCHEMBL6369577 0.87 HMGB1 (0.73) HMGB1CXCL12PTPN1PTPN2PTPN6
SCHEMBL9480008 0.84 HMGB1 (0.55) HMGB1CXCL12PTPN1PTPN2PTPN6
SCHEMBL27609813 0.82 PTPN1 (0.62) HMGB1CXCL12PTPN1PTPN2PTPN6
SCHEMBL17262506 0.82 HMGB1 (0.56) HMGB1CXCL12PTPN1PTPN2PTPN6
SCHEMBL5444611 0.81 PTPN1 (1.00) HMGB1CXCL12PTPN1PTPN2PTPN6
SCHEMBL29236440 0.80 PTPN1 (0.97) HMGB1CXCL12PTPN1PTPN2PTPN6
SCHEMBL9652211 0.80 PTPN1 (0.63) HMGB1CXCL12PTPN1PTPN2PTPN6
SCHEMBL28346820 0.80 HMGB1 (0.53) HMGB1CXCL12PTPN1PTPN2PTPN6

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
EP-4022391-A2 HEAT SENSITIVE RECORDING MATERIAL WITH NON-PHENOLIC COLOR DEVELOPERS Solenis Technologies Cayman, L.P. (KY) 2022-07-06 EP disclosed