SCHEMBL4908158

SCHEMBL4908158

Cc1ccc(Cc2ccccc2C(=O)O)cc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.72
CA1 P00915 1/20 0.57
CA2 P00918 1/20 0.57
CA9 Q16790 1/20 0.57
AKR1C3 P42330 1/20 0.56
FOLH1 Q04609 1/20 0.53
CYP3A4 P08684 1/20 0.51
CYP2D6 P10635 1/20 0.51
CYP2C19 P33261 1/20 0.51
SRD5A2 P31213 1/20 0.50
PTPN1 P18031 4/20 0.49
ALDH1A1 P00352 1/20 0.49
SLC16A3 O15427 1/20 0.48
CYP2C9 P11712 1/20 0.48
HIF1A Q16665 1/20 0.48
HTT P42858 1/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
TP53 P04637 1/20 0.47
SMN1; SMN2 Q16637 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
SCHEMBL10727676 0.87 TSHR (0.54) TSHRCA1CA2CA9AKR1C3
SCHEMBL23003 0.87 TSHR (0.79) TSHRCA1CA2CA9FOLH1
SCHEMBL27879975 0.86 TSHR (0.58) TSHRAKR1C3CYP3A4CYP2D6CYP2C19
SCHEMBL10692630 0.86 TSHR (0.72) TSHRCA1CA2CA9FOLH1
Acetic Acid SCHEMBL28245857 0.85 TSHR (0.71) TSHRCA1CA2CA9FOLH1
SCHEMBL28370887 0.85 TSHR (0.76) TSHRCA1CA2CA9FOLH1
Ammonia Solution, Strong SCHEMBL27527756 0.85 TSHR (0.76) TSHRCA1CA2CA9FOLH1
SCHEMBL4848573 0.85 TSHR (0.53) TSHRCA1CA2CA9AKR1C3
SCHEMBL9450042 0.85 KDM4E (0.56) TSHRCA1CA2CA9AKR1C3
SCHEMBL9644043 0.84 ALDH1A1 (0.67) TSHRAKR1C3FOLH1ALDH1A1SLC16A3

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
US-8354359-B2 Heat-sensitive adhesive agent and heat-sensitive adhesive sheet RICOH COMPANY, LTD. (JP) 2013-01-15 US disclosed
US-7470809-B2 Process for the production of [2-(4-fluoro-benzyl)-phenyl]-acetic acid JANSSEN PHARMACEUTICA N.V. (BE) 2008-12-30 US disclosed
US-20080176012-A1 Heat-sensitive adhesive agent and heat-sensitive adhesive sheet RICOH COMPANY, LTD. (JP) 2008-07-24 US disclosed
EP-1897925-A1 Heat-sensitive adhesive agent and heat-sensitive adhesive sheet Ricoh Company, Ltd. (JP) 2008-03-12 EP disclosed