SCHEMBL3967541

SCHEMBL3967541

CC1=C(C(=O)Cl)SCCO1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.51
HSD17B10 Q99714 1/20 0.51
KMT2A Q03164 9/20 0.38
MEN1 O00255 5/20 0.38
NPC1 O15118 3/20 0.38
RAB9A P51151 4/20 0.37
POLB P06746 3/20 0.36
TDP1 Q9NUW8 2/20 0.36
ADRB2 P07550 1/20 0.34

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
SCHEMBL7833221 0.82 MAPK1 (0.57) MAPK1HSD17B10KMT2AMEN1NPC1
SCHEMBL3805634 0.80 MAPK1 (0.51) MAPK1HSD17B10KMT2AMEN1NPC1
SCHEMBL8930247 0.77 MAPK1 (0.60) MAPK1HSD17B10KMT2AMEN1NPC1
SCHEMBL8930176 0.76 MAPK1 (0.35) MAPK1HSD17B10KMT2AMEN1NPC1
SCHEMBL8440916 0.74 MAPK1 (0.47) MAPK1HSD17B10KMT2AMEN1NPC1
SCHEMBL3767102 0.72 MAPK1 (0.32) MAPK1HSD17B10
SCHEMBL7596951 0.69 MAPK1 (0.58) MAPK1HSD17B10KMT2AMEN1NPC1
Carboxin SCHEMBL8819780 0.69 MAPK1 (1.00) MAPK1HSD17B10KMT2AMEN1NPC1
SCHEMBL17471577 0.68 MAPK1 (0.57) MAPK1HSD17B10KMT2ANPC1RAB9A
SCHEMBL11375431 0.67 MAPK1 (0.71) MAPK1HSD17B10KMT2AMEN1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1509513-B1 MICROBICIDAL OXATHIINCARBOXAMIDES BAYER CROPSCIENCE AG (DE) 2009-07-29 EP disclosed
EP-1509513-B1 MICROBICIDAL OXATHIINCARBOXAMIDES BAYER CROPSCIENCE AG (DE) 2009-07-29 EP disclosed
US-7119049-B2 Oxathiinecarboxamides BAYER CROPSCIENCE AG (DE) 2006-10-10 US disclosed
US-20050203171-A1 Oxathiincarboxamides BAYER CROPSCIENCE AG (DE) 2005-09-15 US disclosed
EP-1509513-A1 OXATHIINCARBOXAMIDES Bayer CropScience AG (DE) 2005-03-02 EP disclosed
WO-2003099804-A1 OXATHIINCARBOXAMIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2003-12-04 WO disclosed
US-5693827-A Treatment of HIV infections and compounds useful therein UNIROYAL CHEMICAL COMPANY, INC. 1997-12-02 US disclosed
EP-0497816-B1 TREATMENT OF HIV INFECTIONS AND COMPOUNDS USEFUL THEREIN UNIROYAL CHEMICAL LTD (CA) 1995-05-17 EP disclosed
US-5268389-A Containing a benzene ring UNIROYAL CHEMICAL COMPANY, INC. (US) 1993-12-07 US disclosed
EP-0497816-A1 TREATMENT OF HIV INFECTIONS AND COMPOUNDS USEFUL THEREIN. UNIROYAL CHEMICAL LTD (CA) 1992-08-12 EP disclosed
US-5075488-A Fungicides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-12-24 US disclosed
EP-0128006-B1 A SOIL-DISEASE-CONTROLLING AGENT SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-09-18 EP disclosed
WO-1991005761-A1 TREATMENT OF HIV INFECTIONS AND COMPOUNDS USEFUL THEREIN UNIROYAL CHEMICAL LTD./UNIROYAL CHEMICAL LTEE (CA) 1991-05-02 WO disclosed
US-4709052-A FUNGICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1987-11-24 US disclosed
EP-0128006-A2 A soil-disease-controlling agent SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1984-12-12 EP 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 (1 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-20050203171-A1 Oxathiincarboxamides MRPL21, ODC1, DDT MAPK1 4217/4885HSD17B10 3440/4885KMT2A 1978/4885

“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.