SCHEMBL10697079

SCHEMBL10697079

CCCCCCCCCCCCCCCCCCOc1cccc(C(=O)O)c1O

nearest known ligand 0.65

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.60
NR1I2 O75469 1/20 0.60
LMNA P02545 1/20 0.60
CHRM2 P08172 1/20 0.60
CYP3A4 P08684 1/20 0.60
ADRA2A P08913 1/20 0.60
MAPT P10636 1/20 0.60
OPRK1 P41145 1/20 0.60
HTR2B P41595 1/20 0.60
SLC6A3 Q01959 1/20 0.60
KMT2A Q03164 1/20 0.60
HDAC6 Q9UBN7 1/20 0.60
PTPN11 Q06124 5/20 0.56
PTPN1 P18031 1/20 0.53
S1PR3 Q99500 1/20 0.52

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
SCHEMBL3157236 1.00 MEN1 (0.60) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL10696267 1.00 MEN1 (0.60) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL10695463 1.00 MEN1 (0.60) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL9845258 1.00 MEN1 (0.60) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL458732 1.00 MEN1 (0.60) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL10697925 1.00 MEN1 (0.60) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL9845253 1.00 MEN1 (0.60) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL9845257 1.00 MEN1 (0.60) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL4960309 0.94 KMT2A (0.51) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL9780500 0.90 CYP3A4 (0.57) MEN1NR1I2LMNACHRM2CYP3A4

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-0275203-A2 Heat-sensitive recording material containing color forming components FUJI PHOTO FILM CO., LTD. (JP) 1988-07-20 EP disclosed