SCHEMBL10784157

SCHEMBL10784157

Cc1cc(C(O)C(Cl)(Cl)Cl)c(O)c(C(O)C(Cl)(Cl)Cl)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SELL P14151 1/20 0.37
SELP P16109 1/20 0.37
SELE P16581 1/20 0.37
ALDH1A1 P00352 3/20 0.37
CA2 P00918 2/20 0.37
POLB P06746 1/20 0.37
TYR P14679 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
GABRA1 P14867 3/20 0.35
GABRB1 P18505 3/20 0.35
CA1 P00915 1/20 0.33
ACHE P22303 1/20 0.32
KDM4E B2RXH2 1/20 0.31
LMNA P02545 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
GABRB2 P47870 1/20 0.31
ERN1 O75460 1/20 0.31
HPGD P15428 1/20 0.31
HSPA5 P11021 1/20 0.31

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
SCHEMBL10897678 0.78 GABRA1 (0.50) GABRA1GABRB1GABRB2
SCHEMBL7073802 0.78 SELL (0.37) SELLSELPSELEALDH1A1CA2
SCHEMBL7119138 0.78 TRPA1 (0.45) ALDH1A1POLBKDM4ELMNAGAA
SCHEMBL7117948 0.74 TRPA1 (0.57) SELLSELPSELEALDH1A1POLB
SCHEMBL9614164 0.72 CA2 (0.44) SELLSELPSELEALDH1A1CA2
SCHEMBL10899086 0.71 ALDH1A1 (0.40) SELLSELPSELEALDH1A1CA2
SCHEMBL23172258 0.71 HTT (0.34) ALDH1A1GABRA1CA1MAPTHPGD
SCHEMBL9121770 0.71 SLC6A2 (0.35) ALDH1A1CA1KDM4ELMNAGAA
SCHEMBL10899297 0.70 GABRA1 (0.44) SELLSELPSELEALDH1A1CA2
SCHEMBL7128980 0.69 ALDH1A1 (0.48) ALDH1A1CA2SMN1; SMN2GABRA1GABRB1

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
EP-0117759-B1 POLYNUCLEAR POLYHYDRIC PHENOLS AND PROCESS FOR PREPARATION THEREOF MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1987-09-30 EP disclosed
US-4614826-A CURABLE TO EPOXY RESINS; HEAT RESISTANCE MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1986-09-30 US disclosed
EP-0117759-A1 Polynuclear polyhydric phenols and process for preparation thereof MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1984-09-05 EP disclosed