SCHEMBL4398265

SCHEMBL4398265

CCN(CC)/C(=N/C(=S)Nc1ccccc1)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.55
RAB9A P51151 2/20 0.55
GAA P10253 1/20 0.55
SMN1; SMN2 Q16637 2/20 0.46
MAPK1 P28482 1/20 0.46
KMT2A Q03164 2/20 0.43
POLB P06746 1/20 0.43
GLA P06280 1/20 0.42
CACNA1B Q00975 1/20 0.42
APBA1 Q02410 1/20 0.42
TAS2R38 P59533 2/20 0.42
ALDH1A1 P00352 2/20 0.41
HSD17B10 Q99714 2/20 0.41
HPGD P15428 1/20 0.41
KDM4E B2RXH2 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
TP53 P04637 1/20 0.40
MAPT P10636 1/20 0.40
CYP3A4 P08684 1/20 0.40

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
SCHEMBL4398428 1.00 NPC1 (0.55) NPC1RAB9AGAASMN1; SMN2MAPK1
SCHEMBL4397899 0.91 GLA (0.55) NPC1RAB9AGAASMN1; SMN2MAPK1
SCHEMBL4397161 0.90 RAB9A (0.50) NPC1RAB9AGAASMN1; SMN2KMT2A
SCHEMBL4397239 0.90 RAB9A (0.50) NPC1RAB9AGAASMN1; SMN2KMT2A
SCHEMBL4397162 0.88 NPC1 (0.56) NPC1RAB9AGAASMN1; SMN2KMT2A
SCHEMBL4393306 0.86 GLA (0.50) NPC1RAB9AGAASMN1; SMN2MAPK1
SCHEMBL4394289 0.83 NPC1 (0.49) NPC1RAB9AGAASMN1; SMN2MAPK1
SCHEMBL4400060 0.83 NPC1 (0.49) NPC1RAB9AGAASMN1; SMN2MAPK1
SCHEMBL4402572 0.82 POLB (0.47) NPC1RAB9AGAASMN1; SMN2KMT2A
SCHEMBL4402576 0.82 POLB (0.47) NPC1RAB9AGAASMN1; SMN2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1897590-B1 PREPARATION FOR USE IN A METHOD OF MAGNETIC THERAPY OF MALIGNANT NEOPLASMS TISHIN ALEKSANDR METTALINOVICH (RU) 2016-11-09 EP disclosed
US-8829014-B2 Thiazole and thiophene analogues, and their use in treating autoimmune diseases and cancers BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL AND MECHANICAL COLLEGE (US) 2014-09-09 US disclosed
EP-2007393-B1 THIAZOLE AND THIOPHENE ANALOGUES, AND THEIR USE IN TREATING AUTOIMMUNE DISEASES AND CANCERS UNIV LOUISIANA STATE (US) 2013-08-21 EP disclosed
US-20120283268-A1 Thiazole and Thiophene Analogues, and Their Use in Treating Autoimmune Diseases and Cancers GIORDANO ANTHONY (US) 2012-11-08 US disclosed
US-8217037-B2 Thiazole and thiophene analogues, and their use in treating autoimmune diseases and cancers BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL AND MECHANICAL COLLEGE (US) 2012-07-10 US disclosed
US-20090306073-A1 Thiazole and Thiophene Analogues, and Their Use in Treating Autoimmune Diseases and Cancers B.V. PATEL PHARMACEUTICAL EDUCATION & RESEARCH DEVELOPMENT (PERD) CENTRE (IN) 2009-12-10 US disclosed
EP-2007393-A2 THIAZOLE AND THIOPHENE ANALOGUES, AND THEIR USE IN TREATING AUTOIMMUNE DISEASES AND CANCERS Board Of Supervisors Of Louisiana State University And Agricultural And Mechanical College (US) 2008-12-31 EP disclosed
EP-1897590-A1 METHOD FOR CARRYING OUT A MAGNETIC THERAPY OF MALIGNANT NEOPLASMS Obschestvo S Ogranichnnoi Otvetsvennostyu "Perspe (RU) 2008-03-12 EP disclosed
WO-2007118149-A2 THIAZOLE AND THIOPHENE ANALOGUES, AND THEIR USE IN TREATING AUTOIMMUNE DISEASES AND CANCERS BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL AND MECHANICAL LOLLEGE (US) 2007-10-18 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090306073-A1 Thiazole and Thiophene Analogues, and Their Use in Treating Autoimmune Diseases and Cancers TPMT, TST, SSB NPC1 3673/4885RAB9A 3231/4885GAA 3490/4885
US-20120283268-A1 Thiazole and Thiophene Analogues, and Their Use in Treating Autoimmune Diseases and Cancers TPMT, TST, SSB NPC1 3673/4885RAB9A 3231/4885GAA 3490/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.