SCHEMBL10698350

SCHEMBL10698350

CCCCc1ccccc1OC(C)OOc1ccccc1C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.50
MEN1 O00255 1/20 0.50
RECQL P46063 1/20 0.50
KMT2A Q03164 1/20 0.50
PPARA Q07869 2/20 0.41
ALDH1A1 P00352 4/20 0.41
THRA P10827 1/20 0.41
THRB P10828 1/20 0.41
PPARG P37231 1/20 0.40
HSD17B10 Q99714 3/20 0.40
HPGD P15428 2/20 0.40
HTT P42858 1/20 0.40
ESR1 P03372 1/20 0.38
ITGB3 P05106 1/20 0.38
ITGA2B P08514 1/20 0.38
HMGB1 P09429 1/20 0.38
TSHR P16473 1/20 0.38
GGT1 P19440 1/20 0.38
PTGS1 P23219 1/20 0.38
PTGS2 P35354 1/20 0.38

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
SCHEMBL10698407 0.95 PPARA (0.48) KDM4EMEN1RECQLKMT2APPARA
SCHEMBL10698344 0.83 KDM4E (0.47) KDM4EMEN1RECQLKMT2APPARA
SCHEMBL4573947 0.80 KDM4E (0.57) KDM4EMEN1RECQLKMT2APPARA
SCHEMBL10698402 0.79 PPARA (0.51) KDM4EMEN1RECQLKMT2APPARA
SCHEMBL9551796 0.77 KDM4E (0.49) KDM4EMEN1RECQLKMT2AALDH1A1
SCHEMBL18140330 0.77 THRA (0.44) PPARATHRATHRBPPARGTSHR
SCHEMBL10697509 0.77 HTT (0.47) KDM4EMEN1RECQLKMT2AALDH1A1
SCHEMBL11610168 0.75 ALDH1A1 (0.51) MEN1KMT2APPARAALDH1A1THRA
SCHEMBL10595073 0.75 PPARG (0.48) KDM4EMEN1RECQLKMT2APPARA
SCHEMBL6151350 0.75 PPARA (0.58) KDM4EMEN1RECQLKMT2APPARA

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