SCHEMBL10600232

SCHEMBL10600232

CCCOC(=O)c1ccc(-c2ccc(C(=O)O)c(C(=O)O)c2-c2ccc(C(=O)OCCC)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.50
ALDH1A1 P00352 5/20 0.49
TSHR P16473 3/20 0.49
ESR1 P03372 2/20 0.49
CHRM1 P11229 1/20 0.49
SLC6A2 P23975 1/20 0.49
KDR P35968 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
SMN1; SMN2 Q16637 3/20 0.43
NPC1 O15118 3/20 0.43
MAPT P10636 3/20 0.43
RAB9A P51151 2/20 0.43
STAT1 P42224 1/20 0.43
STS P08842 1/20 0.42
PTPN11 Q06124 1/20 0.42
HPGD P15428 2/20 0.41
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
THRB P10828 1/20 0.41
CYP1A2 P05177 2/20 0.40

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
SCHEMBL10600800 0.85 LMNA (0.60) LMNAALDH1A1TSHRESR1CHRM1
SCHEMBL6870968 0.82 EGFR (0.50) ALDH1A1TSHRTDP1SMN1; SMN2MAPT
SCHEMBL10344351 0.81 KMT2A (0.54) LMNAALDH1A1ESR1SLC6A2TDP1
SCHEMBL9718262 0.81 PTPN11 (0.55) LMNAALDH1A1TSHRESR1SMN1; SMN2
SCHEMBL10603466 0.79 CA12 (0.46) LMNAALDH1A1TSHRESR1SMN1; SMN2
SCHEMBL10787325 0.79 FOLH1 (0.47) TSHRNPC1RAB9APTPN11CYP2C9
SCHEMBL20957987 0.78 ESR1 (0.61) LMNAALDH1A1TSHRESR1CHRM1
SCHEMBL10605528 0.77 LMNA (0.60) LMNAALDH1A1TSHRESR1TDP1
SCHEMBL28881217 0.75 ALDH1A1 (0.75) LMNAALDH1A1TSHRESR1CHRM1
SCHEMBL11634681 0.75 ALDH1A1 (0.58) LMNAALDH1A1TSHRCHRM1TDP1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0168819-B1 THERMOSENSITIVE RECORDING SHEET JUJO PAPER CO., LTD. (JP) 1989-05-03 EP disclosed
US-4695649-A PESTICIDES, PLASTICIZERS, BISP-BENZYLOXY-CARBONYLPHENYL ISOPHTHALATE YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1987-09-22 US disclosed
US-4628336-A POLYPHENYL ESTERS; SOIL RESISTANCE; IMAGE STABILITY JUJO PAPER CO., LTD. (JP) 1986-12-09 US disclosed
EP-0168819-A2 Thermosensitive recording sheet JUJO PAPER CO., LTD. (JP) 1986-01-22 EP disclosed