SCHEMBL5765414

SCHEMBL5765414

OCC(O)c1ccc2[nH]c(S)nc2c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PYGL P06737 6/20 0.37
▸ CYP3A4 P08684 2/20 0.36
▸ TSHR P16473 1/20 0.36
▸ ACSS2 Q9NR19 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ SCN10A Q9Y5Y9 1/20 0.32
▸ MAPT P10636 2/20 0.31
▸ HPGD P15428 2/20 0.31
▸ APEX1 P27695 2/20 0.31
▸ RECQL P46063 2/20 0.31
▸ BLM P54132 2/20 0.31
▸ TDP1 Q9NUW8 2/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ ADRB2 P07550 1/20 0.31
▸ ADRB1 P08588 1/20 0.31
▸ ADRA2A P08913 1/20 0.31
▸ ADORA3 P0DMS8 1/20 0.31
▸ ADRB3 P13945 1/20 0.31
▸ DRD2 P14416 1/20 0.31

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
SCHEMBL18930958 0.77 SCN10A (0.41) SCN10AMAPTMEN1LMNAKMT2A
SCHEMBL6324712 0.73 HSD17B10 (0.40) RECQLTDP1
SCHEMBL29256510 0.71 CYP3A4 (0.38) PYGLCYP3A4TSHRMAPTHPGD
SCHEMBL30988826 0.71 CYP3A4 (0.38) PYGLCYP3A4TSHRMAPTHPGD
SCHEMBL7718077 0.71 PLAU (0.43) TSHRMAPTHPGDMEN1LMNA
SCHEMBL29822961 0.70 MEN1 (0.32) MAPTMEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL863229 0.70 MEN1 (0.32) MAPTMEN1KMT2AKDM4ESMN1; SMN2
Methyl Alcohol SCHEMBL4797570 0.68 CYP1A2 (0.46) MAPTHPGDMEN1KMT2AKDM4E
SCHEMBL11983002 0.68 SCN10A (0.49) SCN10AHPGDMEN1LMNAKMT2A
SCHEMBL482225 0.67 F7 (0.44) CYP3A4TSHRMAPTHPGDTDP1

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
US-7019147-B1 Benzimidazole derivatives useful as antiproliferative agents PFIZER INC. (US) 2006-03-28 — — US disclosed
EP-1235825-B1 NOVEL BENZOIMIDAZOLE DERIVATIVES USEFUL AS ANTIPROLIFERATIVE AGENTS PFIZER PROD INC (US) 2006-01-25 — — EP disclosed
EP-1235825-A1 NOVEL BENZOIMIDAZOLE DERIVATIVES USEFUL AS ANTIPROLIFERATIVE AGENTS Pfizer Products Inc. (US) 2002-09-04 — — EP disclosed
WO-2001040217-A1 NOVEL BENZOIMIDAZOLE DERIVATIVES USEFUL AS ANTIPROLIFERATIVE AGENTS PFIZER PRODUCTS INC. (US) 2001-06-07 — — WO disclosed
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