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SCHEMBL8566042

SCHEMBL8566042

ClC(Cl)(Cl)C(Cl)(Cl)CCCCCCc1ccc(C(OC(c2ccccc2)(c2ccccc2)c2ccc(CCCCCCC(Cl)(Cl)C(Cl)(Cl)Cl)cc2)(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PTPN2 P17706 1/20 0.36
▸ PTPN1 P18031 1/20 0.36
▸ PTPN6 P29350 1/20 0.36
▸ PTPN11 Q06124 1/20 0.36
▸ MAOB P27338 2/20 0.35
▸ HDAC1 Q13547 1/20 0.35
▸ SIGMAR1 Q99720 6/20 0.34
▸ MAPT P10636 1/20 0.33
▸ RXFP1 Q9HBX9 1/20 0.33
▸ MAOA P21397 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL8569403 0.82 MAOB (0.37) PTPN2PTPN1PTPN6PTPN11MAOB
SCHEMBL8566051 0.80 — —
SCHEMBL8573617 0.79 PTPN2 (0.40) PTPN2PTPN1PTPN6PTPN11MAOB
SCHEMBL9078476 0.77 PTPN2 (0.38) PTPN2PTPN1PTPN6PTPN11MAOB
SCHEMBL8718031 0.75 KIF11 (0.49) —
SCHEMBL417235 0.74 TDP1 (0.42) PTPN2PTPN1PTPN6PTPN11MAOB
SCHEMBL8718233 0.71 — —
SCHEMBL8559690 0.68 SIGMAR1 (0.52) MAOBSIGMAR1MAPTRXFP1MAOA
SCHEMBL9204337 0.67 TP53 (0.52) —
SCHEMBL8973 0.66 KIF11 (0.48) PTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5728641-A Catalyst component for the polymerization of olefins NIPPON OIL COMPANY, LIMITED (JP) 1998-03-17 — — US disclosed