SCHEMBL7485786

SCHEMBL7485786

CCCCN(CCCC)c1ccc(/C=C2\SC(=S)N(C(Cc3cnc[nH]3)C(=O)O)C2=O)cc1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 8/20 0.52
▸ MAPT P10636 4/20 0.51
▸ PLA2G1B P04054 1/20 0.51
▸ POLB P06746 1/20 0.51
▸ ATG4B Q9Y4P1 1/20 0.51
▸ BCL2 P10415 3/20 0.49
▸ BCL2L2 Q92843 3/20 0.49
▸ MME P08473 2/20 0.49
▸ NPC1 O15118 1/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ ALDH1A1 P00352 1/20 0.49
▸ CRHBP P24387 1/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ CRHR2 Q13324 1/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.49
▸ BAD Q92934 1/20 0.49
▸ MCL1 Q07820 1/20 0.47
▸ BAK1 Q16611 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
SCHEMBL7485795 1.00 PTPN1 (0.52) PTPN1MAPTPLA2G1BPOLBATG4B
SCHEMBL7488995 0.85 MAPT (0.71) MAPTPLA2G1BPOLBATG4BBCL2
SCHEMBL7488998 0.85 MAPT (0.71) MAPTPLA2G1BPOLBATG4BBCL2
SCHEMBL7485783 0.81 PTPN1 (0.55) PTPN1MAPTPLA2G1BPOLBATG4B
SCHEMBL7485788 0.81 PTPN1 (0.55) PTPN1MAPTPLA2G1BPOLBATG4B
SCHEMBL6885016 0.75 PTPN12 (0.64) PTPN1KMT2A
SCHEMBL6885013 0.75 PTPN12 (0.64) PTPN1KMT2A
SCHEMBL6793003 0.72 PTPN12 (0.62) PTPN1KMT2A
SCHEMBL6793007 0.72 PTPN12 (0.62) PTPN1KMT2A
SCHEMBL2683718 0.71 MAPT (0.80) MAPTPLA2G1BPOLBATG4BBCL2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1192143-A1 RHODANINE DERIVATIVES FOR USE IN A METHOD OF INHIBITING AMYLOID PROTEIN AGGREGATION AND IMAGING AMYLOID DEPOSITS WARNER-LAMBERT COMPANY (US) 2002-04-03 — — EP claimed
WO-2000076987-A1 RHODANINE DERIVATIVES FOR USE IN A METHOD OF INHIBITING AMYLOID PROTEIN AGGREGATION AND IMAGING AMYLOID DEPOSITS WARNER-LAMBERT COMPANY (US) 2000-12-21 — — WO claimed
EP-1192143-A1 RHODANINE DERIVATIVES FOR USE IN A METHOD OF INHIBITING AMYLOID PROTEIN AGGREGATION AND IMAGING AMYLOID DEPOSITS WARNER-LAMBERT COMPANY (US) 2002-04-03 — — EP disclosed
WO-2000076987-A1 RHODANINE DERIVATIVES FOR USE IN A METHOD OF INHIBITING AMYLOID PROTEIN AGGREGATION AND IMAGING AMYLOID DEPOSITS WARNER-LAMBERT COMPANY (US) 2000-12-21 — — WO disclosed
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