SCHEMBL3274408

SCHEMBL3274408

CC(C)CS(=O)(=O)c1cccc(N)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.55
▸ CA2 P00918 4/20 0.53
▸ CA12 O43570 3/20 0.53
▸ CA1 P00915 3/20 0.53
▸ CA9 Q16790 3/20 0.53
▸ CA4 P22748 2/20 0.53
▸ CA14 Q9ULX7 1/20 0.53
▸ ALDH1A1 P00352 1/20 0.52
▸ TSHR P16473 1/20 0.52
▸ HSD17B10 Q99714 1/20 0.52
▸ TDP1 Q9NUW8 1/20 0.52
▸ CYP19A1 P11511 1/20 0.45
▸ F2 P00734 3/20 0.45
▸ PRSS1 P07477 3/20 0.45
▸ PRSS2 P07478 3/20 0.45
▸ PRSS3 P35030 3/20 0.45
▸ POLB P06746 1/20 0.44
▸ PRMT1 Q99873 1/20 0.42
▸ PKM P14618 1/20 0.41
▸ HTR6 P50406 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
SCHEMBL10103020 0.81 CA1 (0.44) LMNACA2CA12CA1CA9
SCHEMBL29737578 0.81 LMNA (0.63) LMNACA2CA12CA1CA9
SCHEMBL1156252 0.81 LMNA (0.63) LMNACA2CA12CA1CA9
SCHEMBL2319779 0.79 GBA1 (0.42) CA2CA12CA1CA9ALDH1A1
SCHEMBL17618327 0.79 KAT6A (0.41) CA2CA1CA9ALDH1A1TDP1
SCHEMBL2705059 0.77 LARS1 (0.51) ALDH1A1
SCHEMBL4873168 0.77 GAA (0.61) LMNACA2CA12CA1CA9
SCHEMBL778303 0.77 PSIP1 (0.60) ALDH1A1HSD17B10TDP1POLBHTR6
SCHEMBL3024800 0.76 LMNA (0.57) LMNACA2CA12CA1CA9
SCHEMBL17048453 0.76 ADAMTS4 (0.41) CA2ALDH1A1PRSS1PRSS2PRSS3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8207349-B2 Thiazolyl-dihydro-indazoles BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-06-26 — — US disclosed
US-20100113414-A1 THIAZOLYL-DIHYDRO-INDAZOLES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-05-06 — — US disclosed
US-7691888-B2 Thiazolyl-dihydro-indazole BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-04-06 — — US disclosed
EP-1799690-B1 THIAZOLYL-DIHYDRO INDAZOLES BOEHRINGER INGELHEIM INT (DE) 2008-04-16 — — EP disclosed
EP-1799690-A1 THIAZOLYL-DIHYDRO INDAZOLES Boehringer Ingelheim International GmbH (DE) 2007-06-27 — — EP disclosed
US-20060100254-A1 N-[1-(3-dimethylamino-4-formyl-phenyl)-3-pyridin-3-yl-4,5-dihydro-1H-pyrazolo[4,3-g]benzothiazol-7-yl]-acetamide; phosphatidylinositol-3-kinases (PI3-kinases) inhibitor; cell growth, differentiation and intracellular transport processes; antiproliferative, antiinflammatory agent; autoimmune diseases BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2006-05-11 — — US disclosed
WO-2006040281-A1 THIAZOLYL-DIHYDRO INDAZOLES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2006-04-20 — — 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-20060100254-A1 N-[1-(3-dimethylamino-4-formyl-phenyl)-3-pyridin-3-yl-4,5-dihydro-1H-pyrazolo[4,3-g]benzothiazol-7-yl]-acetamide; phosphatidylinositol-3-kinases (PI3-kinases) inhibitor; cell growth, differentiation and intracellular transport processes; antiproliferative, antiinflammatory agent; autoimmune diseases CDK1, MAPK1, NFATC1 LMNA 3941/4885CA2 847/4885CA12 4662/4885
US-20100113414-A1 THIAZOLYL-DIHYDRO-INDAZOLES MKI67, CYP11B1, IGF1R LMNA 4105/4885CA2 1853/4885CA12 3546/4885

“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.

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