SCHEMBL8628997

SCHEMBL8628997

Clc1ccc(-c2ccc(Cl)cc2)cc1.O=C(O)c1cc(Cl)cc(Cl)c1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TPMT P51580 1/20 0.74
RXRA P19793 2/20 0.70
RXRB P28702 2/20 0.70
CTRC Q99895 2/20 0.61
ALOX15 P16050 1/20 0.60
TSHR P16473 1/20 0.60
HCAR1 Q9BXC0 1/20 0.57
NOTUM Q6P988 1/20 0.56
SRD5A2 P31213 2/20 0.54
ALAD P13716 1/20 0.52
AURKA O14965 1/20 0.50
TPX2 Q9ULW0 1/20 0.50
CDH1 P12830 1/20 0.50
APC P25054 1/20 0.50
CTNNB1 P35222 1/20 0.50
TCF7L2 Q9NQB0 1/20 0.50
MAP4K4 O95819 1/20 0.49
CA12 O43570 1/20 0.49
ALPL P05186 1/20 0.49
CHEK2 O96017 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
SCHEMBL491622 0.87 RXRA (0.64) TPMTRXRARXRBCTRCALOX15
SCHEMBL23699 0.86 TPMT (1.00) TPMTRXRARXRBALOX15TSHR
SCHEMBL28214359 0.86 TPMT (1.00) TPMTRXRARXRBALOX15TSHR
SCHEMBL2041424 0.84 TSHR (0.85) RXRARXRBCTRCALOX15TSHR
Iodide SCHEMBL27041428 0.84 TPMT (0.94) TPMTRXRARXRBALOX15TSHR
Hydrochloric Acid SCHEMBL10387707 0.84 TPMT (0.94) TPMTRXRARXRBALOX15TSHR
SCHEMBL8023966 0.84 TPMT (0.94) TPMTRXRARXRBALOX15TSHR
Bromide SCHEMBL27041421 0.84 TPMT (0.94) TPMTRXRARXRBALOX15TSHR
SCHEMBL412461 0.83 RXRA (1.00) TPMTRXRARXRBALOX15TSHR
Hydrochloric Acid SCHEMBL4268387 0.82 TSHR (0.81) RXRARXRBCTRCALOX15TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5824767-A MOLDING MATERIALS FOR MELT SPINNING AND EXTRUSION CONTAINING A BARIUM COMPOUND AND A LUBRICANT; REDUCED ADHESION TO METAL SURFACES HOECHST CELANESE CORPORATION (US) 1998-10-20 US disclosed
EP-0818493-A2 Poly(arylene sulfide) composition having good processability HOECHST CELANESE CORPORATION (US) 1998-01-14 EP disclosed
US-5652287-A BLEND WITH CURED SILICONE RUBBER HOECHST CELANESE CORPORATION (US) 1997-07-29 US disclosed
EP-0372829-B1 Poly(arylene sulfide) sheet and production process thereof KUREHA CHEMICAL IND CO LTD (JP) 1994-08-31 EP disclosed
US-5013823-A Excellent in planarity and smoothness KUREHA KAGAKU KOGYO K.K. (JP) 1991-05-07 US disclosed