SCHEMBL580774

SCHEMBL580774

Oc1c(Cl)cc(CCCc2cc(Cl)c(O)c(-c3ccccc3)c2)cc1-c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 3/20 0.45
PTPN2 P17706 1/20 0.45
PTPN6 P29350 1/20 0.45
CSNK2A1 P68400 2/20 0.45
BACE1 P56817 2/20 0.42
AKR1C2 P52895 2/20 0.40
AKR1C1 Q04828 2/20 0.40
CYP2A6 P11509 1/20 0.39
ACLY P53396 1/20 0.39
THRA P10827 1/20 0.38
THRB P10828 1/20 0.38
ESR2 Q92731 1/20 0.38
ALOX15 P16050 2/20 0.38
IGF1R P08069 1/20 0.38
TNKS2 Q9H2K2 1/20 0.37
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
GAA P10253 1/20 0.36
HTT P42858 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL2806552 0.88 PTGS2 (0.46) AKR1C2AKR1C1ACLYALDH1A1HSD17B10
SCHEMBL10931154 0.87 PTPN1 (0.51) PTPN1PTPN2PTPN6BACE1AKR1C2
SCHEMBL27613247 0.87 CNR1 (0.43) PTPN1PTPN2PTPN6CSNK2A1BACE1
SCHEMBL9178161 0.83 PTPN1 (0.51) PTPN1PTPN2PTPN6BACE1AKR1C2
SCHEMBL8443634 0.83 PTPN1 (0.45) PTPN1PTPN2PTPN6CSNK2A1BACE1
SCHEMBL9183984 0.82 PTPN1 (0.50) PTPN1PTPN2PTPN6BACE1ALOX15
SCHEMBL9180703 0.82 PTPN1 (0.50) PTPN1PTPN2PTPN6BACE1ALOX15
SCHEMBL9182437 0.82 PTPN1 (0.50) PTPN1PTPN2PTPN6BACE1ALOX15
SCHEMBL9181706 0.82 PTPN1 (0.50) PTPN1PTPN2PTPN6BACE1ALOX15
SCHEMBL9185387 0.82 PTPN1 (0.50) PTPN1PTPN2PTPN6BACE1ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020111456-A1 Method of polycarbonate preparation SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2002-08-15 US claimed
WO-2001085825-A2 METHOD OF POLYCARBONATE PREPARATION GENERAL ELECTRIC COMPANY (US) 2001-11-15 WO claimed
EP-1307499-B2 CONTINUOUS PREPARATION OF POLYCARBONATE GEN ELECTRIC (US) 2012-02-15 EP disclosed
EP-1307499-B1 CONTINUOUS PREPARATION OF POLYCARBONATE GEN ELECTRIC (US) 2006-10-25 EP disclosed
US-6562937-B2 Endcapping with phenol GENERAL ELECTRIC COMPANY 2003-05-13 US disclosed
EP-1307499-A2 CONTINUOUS PREPARATION OF POLYCARBONATE GENERAL ELECTRIC COMPANY (US) 2003-05-07 EP disclosed
US-20020111456-A1 Method of polycarbonate preparation SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2002-08-15 US disclosed
US-20020035234-A1 Continuous preparation of polycarbonate GENERAL ELECTRIC COMPANY 2002-03-21 US disclosed
WO-2002008311-A2 CONTINUOUS PREPARATION OF POLYCARBONATE GENERAL ELECTRIC COMPANY (US) 2002-01-31 WO disclosed
WO-2001085825-A2 METHOD OF POLYCARBONATE PREPARATION GENERAL ELECTRIC COMPANY (US) 2001-11-15 WO disclosed