SCHEMBL7170699

SCHEMBL7170699

O=C(C=Cc1cc(Cl)cc(Cl)c1O)c1ccc(Cl)cc1.O=C(C=Cc1cc(Cl)cc(Cl)c1O)c1ccccc1Cl

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.56
▸ MAPK1 P28482 1/20 0.56
▸ PTPN5 P54829 1/20 0.54
▸ MEN1 O00255 2/20 0.52
▸ KMT2A Q03164 2/20 0.52
▸ HSP90AA1 P07900 1/20 0.52
▸ KDM4E B2RXH2 2/20 0.49
▸ SMN1; SMN2 Q16637 2/20 0.49
▸ POLB P06746 1/20 0.49
▸ ALOX12 P18054 1/20 0.49
▸ NFKB1 P19838 1/20 0.49
▸ HTT P42858 1/20 0.49
▸ NFKB2 Q00653 1/20 0.49
▸ RELA Q04206 1/20 0.49
▸ NPSR1 Q6W5P4 1/20 0.49
▸ TDP1 Q9NUW8 1/20 0.49
▸ PTGS1 P23219 1/20 0.49
▸ PTGS2 P35354 1/20 0.49
▸ CYP1B1 Q16678 1/20 0.49
▸ LMNA P02545 2/20 0.48

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
SCHEMBL7170696 1.00 MAPT (0.56) MAPTMAPK1PTPN5MEN1KMT2A
SCHEMBL30384257 0.92 PTPN5 (0.58) MAPTPTPN5MEN1KMT2AHSP90AA1
SCHEMBL1225320 0.92 PTPN5 (0.58) MAPTPTPN5MEN1KMT2AHSP90AA1
SCHEMBL1225321 0.92 PTPN5 (0.58) MAPTPTPN5MEN1KMT2AHSP90AA1
SCHEMBL7172457 0.91 PTGS2 (0.53) MAPTMAPK1PTPN5MEN1KMT2A
SCHEMBL7172458 0.91 PTGS2 (0.53) MAPTMAPK1PTPN5MEN1KMT2A
SCHEMBL1225024 0.89 MAPT (0.59) MAPTMAPK1PTPN5MEN1KMT2A
SCHEMBL30383707 0.89 MAPT (0.59) MAPTMAPK1PTPN5MEN1KMT2A
SCHEMBL1225026 0.89 MAPT (0.59) MAPTMAPK1PTPN5MEN1KMT2A
SCHEMBL7171726 0.80 CXCL12 (0.58) MAPTMAPK1PTGS2CYP1B1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1355921-A2 MODULATORS OF CELLULAR PROLIFERATION AND ANGIOGENESIS, METHODS FOR USE AND IDENTIFICATION THEREOF North Shore-Long Island Jewish Health System (US) 2003-10-29 — — EP disclosed
WO-2002002593-A2 MODULATORS OF CELLULAR PROLIFERATION AND ANGIOGENESIS, METHODS FOR USE AND IDENTIFICATION THEREOF NORTH SHORE-LONG ISLAND JEWISH HEALTH SYSTEM (US) 2002-01-10 — — WO disclosed
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