SCHEMBL11089474

SCHEMBL11089474

Nc1c(CC(=O)O)cccc1Oc1ccc(Cl)cc1Cl

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 1/20 0.76
CXCL8 P10145 1/20 0.56
HPGD P15428 2/20 0.50
ALDH1A1 P00352 1/20 0.50
POLB P06746 1/20 0.50
GAA P10253 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
CYP2C9 P11712 1/20 0.50
CAMK2A Q9UQM7 1/20 0.49
MAPT P10636 2/20 0.48
PLA2G1B P04054 1/20 0.48
ATG4B Q9Y4P1 1/20 0.48
MRGPRX4 Q96LA9 4/20 0.48
SLC6A2 P23975 4/20 0.48
SLC6A3 Q01959 4/20 0.48
SLC6A4 P31645 3/20 0.48
TDP1 Q9NUW8 1/20 0.48
FFAR1 O14842 1/20 0.46
TTR P02766 2/20 0.46
NR1I2 O75469 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
SCHEMBL11094498 0.87 CHRM1 (0.57) CHRM1HPGDALDH1A1POLBGAA
SCHEMBL11084311 0.86 CXCL8 (0.75) CHRM1CXCL8CAMK2ASLC6A2SLC6A3
Fenclofenac SCHEMBL28279765 0.86 CHRM1 (1.00) CHRM1CXCL8HPGDCYP2C9CAMK2A
Fenclofenac SCHEMBL30509659 0.86 CHRM1 (1.00) CHRM1CXCL8HPGDCYP2C9CAMK2A
Fenclofenac SCHEMBL25161 0.86 CHRM1 (1.00) CHRM1CXCL8HPGDCYP2C9CAMK2A
Fenclofenac SCHEMBL29438086 0.86 CHRM1 (1.00) CHRM1CXCL8HPGDCYP2C9CAMK2A
Fenclofenac SCHEMBL9692633 0.85 CHRM1 (0.97) CHRM1CXCL8HPGDCYP2C9CAMK2A
SCHEMBL11095059 0.84 CXCL8 (0.56) CHRM1CXCL8HPGDL3MBTL1CYP2C9
SCHEMBL11097033 0.84 CHRM1 (0.54) CHRM1HPGDALDH1A1POLBGAA
SCHEMBL11089469 0.82 CXCL8 (0.60) CHRM1CXCL8CAMK2AMRGPRX4TTR

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-4472433-A Phenoxyphenyl acetic acids and their medicinal use FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-09-18 US disclosed
EP-0008226-B1 PHENYL-ALKANOIC ACID DERIVATIVES, THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1983-11-02 EP disclosed
EP-0008226-A2 Phenyl-alkanoic acid derivatives, the preparation thereof and pharmaceutical compositions containing them FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1980-02-20 EP disclosed