SCHEMBL2956458

SCHEMBL2956458

OC(=S)c1ccc(Cl)cc1O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 5/20 0.50
ALDH1A1 P00352 4/20 0.50
CYP3A4 P08684 4/20 0.50
TSHR P16473 3/20 0.50
TDP1 Q9NUW8 1/20 0.50
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
SMN1; SMN2 Q16637 3/20 0.43
CASP1 P29466 2/20 0.43
HPGD P15428 5/20 0.41
ALOX15 P16050 4/20 0.41
ALOX12 P18054 2/20 0.41
MAPK1 P28482 1/20 0.41
HSP90AA1 P07900 4/20 0.41
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
HIF1A Q16665 3/20 0.40
HTT P42858 2/20 0.40
LMNA P02545 2/20 0.40
MAPT P10636 2/20 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
SCHEMBL6401692 0.82 CA1 (0.63) HSD17B10ALDH1A1CYP3A4TSHRTDP1
SCHEMBL11207523 0.80 CA1 (0.61) HSD17B10ALDH1A1CYP3A4TSHRTDP1
SCHEMBL9587172 0.79 TSHR (0.61) HSD17B10ALDH1A1TSHRSMN1; SMN2CASP1
SCHEMBL31568534 0.79 TSHR (0.61) HSD17B10ALDH1A1TSHRSMN1; SMN2CASP1
SCHEMBL132175 0.77 CA1 (0.69) HSD17B10ALDH1A1CYP3A4TSHRTDP1
Hydrochloric Acid SCHEMBL7085459 0.76 CA1 (0.67) HSD17B10ALDH1A1CYP3A4TSHRTDP1
SCHEMBL9555501 0.76 NOX1 (0.47) ALDH1A1CYP3A4TSHRSMN1; SMN2CASP1
SCHEMBL4093981 0.75 KDM4E (0.43) HSD17B10ALDH1A1CYP3A4TSHRTDP1
SCHEMBL27612735 0.74 CA1 (0.54) HSD17B10ALDH1A1CYP3A4TSHRTDP1
SCHEMBL9586283 0.74 TP53 (0.61) HSD17B10ALDH1A1CYP3A4TSHRTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7767665-B2 3-[6-(4-oxo-4H-1,3-benzothiazin-2-yl)-2-pyridyl]propionic acid, having an excellent apoptosis inhibitory and Macrophage migration inhibitory factor (MIF) binding effects, used for preventing and/or treating cancers, AIDS, cardiovascular, neurodegeneartive, bone, kidney and liver disoders TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-08-03 US disclosed
WO-2009075691-A1 CB-1 MODULATING COMPOUNDS AND THEIR USE ACADIA PHARMACEUTICALS INC. (US) 2009-06-18 WO disclosed
US-20090082343-A1 1,3-BENZOTHIAZINONE DERIVATIVES AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-03-26 US disclosed
WO-2008118141-A2 USE OF CANNABINOID MODULATING COMPOUNDS IN COMBINATION WITH OTHER THERAPEUTIC COMPOUNDS FOR ADJUNCTIVE THERAPY ACADIA PHARMACEUTICALS INC. (US) 2008-10-02 WO disclosed
US-7399759-B2 1, 3-benzothiazinone derivatives and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-07-15 US disclosed
US-20080090805-A1 CB-1 MODULATING COMPOUNDS AND THEIR USE ACADIA PHARMACEUTICALS INC. (US) 2008-04-17 US disclosed
US-20050119237-A1 Non-malignant disease treatment with Ras antagonists RAMOT UNIVERSITY AUTHORITY FOR APPLIED RESEARCH & INDUSTRIAL DEVELOPMENT LTD. (IL) 2005-06-02 US disclosed
US-20050032786-A1 1, 3-benzothiazinone derivatives and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2005-02-10 US disclosed
EP-1424336-A1 1,3-BENZOTHIAZINONE DERIVATIVES AND USE THEREOF Takeda Chemical Industries, Ltd. (JP) 2004-06-02 EP disclosed
EP-1187605-A4 NON-MALIGNANT DISEASE TREATMENT WITH RAS ANTAGONISTS THYREOS CORP (US) 2004-05-26 EP disclosed
US-6462086-B1 SUCH AS FARNESYLTHIOSALICYLIC ACID; INHIBITING PROLIFERATION OF T-CELLS; DIABETES, LUPUS, MULTIPLE SCLEROSIS; GRAFT REJECTION INDUCED BY FOREIGN ANTIGENS; CIRRHOSIS, RESTENOSIS RAMOT UNIVERSITY AUTHORITY FOR APPLIED RESEARCH AND INDUSTRIAL DEVELOPMENT LTD. (IL) 2002-10-08 US disclosed
EP-1187605-A1 NON-MALIGNANT DISEASE TREATMENT WITH RAS ANTAGONISTS Thyreos Corporation (US) 2002-03-20 EP disclosed
WO-2000078303-A1 NON-MALIGNANT DISEASE TREATMENT WITH RAS ANTAGONISTS THYREOS CORPORATION (US) 2000-12-28 WO disclosed
EP-0026000-B1 SPIRO COMPOUNDS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Takeda Chemical Industries, Ltd. (JP) 1983-05-11 EP disclosed
US-4362740-A ANTICOAGULANTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1982-12-07 US disclosed
EP-0026000-A1 Spiro compounds, process for their preparation and pharmaceutical compositions containing them Takeda Chemical Industries, Ltd. (JP) 1981-04-01 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 (4 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-20090082343-A1 1,3-BENZOTHIAZINONE DERIVATIVES AND USE THEREOF MIF, MORF4L1, FOXM1 HSD17B10 648/4885ALDH1A1 273/4885CYP3A4 1744/4885
US-20050119237-A1 Non-malignant disease treatment with Ras antagonists RSU1, KSR1, KRAS HSD17B10 4164/4885ALDH1A1 4061/4885CYP3A4 4608/4885
US-20080090805-A1 CB-1 MODULATING COMPOUNDS AND THEIR USE CNR1, CNR2, FAAH HSD17B10 2065/4885ALDH1A1 888/4885CYP3A4 1595/4885
US-20050032786-A1 1, 3-benzothiazinone derivatives and use thereof MIF, MORF4L1, FOXM1 HSD17B10 648/4885ALDH1A1 273/4885CYP3A4 1744/4885

“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.