SCHEMBL7794739

SCHEMBL7794739

O=C(SCCCCCSC(=O)c1nc2cc(Cl)ccc2[nH]1)c1nc2cc(Cl)ccc2[nH]1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 8/20 0.41
KMT2A Q03164 2/20 0.40
MAPT P10636 2/20 0.40
HRH3 Q9Y5N1 2/20 0.39
RHEB Q15382 1/20 0.39
RAB9A P51151 1/20 0.39
HSD17B10 Q99714 1/20 0.39
NTSR1 P30989 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
PKM P14618 1/20 0.38
HPGD P15428 1/20 0.38
NPY1R P25929 1/20 0.38
NPY2R P49146 1/20 0.38
F7 P08709 1/20 0.36
F3 P13726 1/20 0.36
SIRT1 Q96EB6 1/20 0.36
EGLN1 Q9GZT9 1/20 0.36
KDR P35968 1/20 0.35

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
Hydrochloric Acid SCHEMBL7794719 0.99 HRH4 (0.40) HRH4KMT2AMAPTHRH3RHEB
SCHEMBL7794740 0.89 HRH4 (0.52) HRH4KMT2AMAPTHRH3RAB9A
Hydrochloric Acid SCHEMBL7794721 0.88 HRH4 (0.51) HRH4KMT2AMAPTHRH3RAB9A
SCHEMBL7792319 0.84 PIN1 (0.47) HRH4KMT2AMAPTRAB9AHSD17B10
SCHEMBL7786132 0.83 EGLN1 (0.52) RHEBEGLN1LMNA
SCHEMBL7796287 0.81 PIN1 (0.50) KMT2AMAPTRAB9AMEN1TDP1
SCHEMBL7796360 0.81 EGLN1 (0.46) KMT2AMAPTRAB9AMEN1ALDH1A1
SCHEMBL7786244 0.80 DAGLA (0.52) HRH4KMT2AMAPTRAB9ASMN1; SMN2
SCHEMBL7796230 0.80 DAGLA (0.52) HRH4KMT2AMAPTRAB9ASMN1; SMN2
SCHEMBL7794696 0.80 DAGLA (0.52) HRH4KMT2AMAPTRAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0742210-B1 2-MERCAPTOBENZIMIDAZOLE DERIVATIVE AND ANTIHYPERLIPEMIC OR ANTIARTERIOSCLEROTIC AGENT CONTAINING THE SAME FUJI PHOTO FILM CO LTD (JP) 2001-11-21 EP disclosed
US-5962493-A HYPOLIPEMIC AGENTS; ANTICHOLESTEROL AGENTS FUJI PHOTO FILM CO., LTD. (JP) 1999-10-05 US disclosed
EP-0742210-A1 2-MERCAPTOBENZIMIDAZOLE DERIVATIVE AND ANTIHYPERLIPEMIC OR ANTIARTERIOSCLEROTIC AGENT CONTAINING THE SAME FUJI PHOTO FILM CO., LTD. (JP) 1996-11-13 EP disclosed