SCHEMBL1161572

SCHEMBL1161572

CC(C(N)=O)S(=O)(=O)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.54
CA1 P00915 3/20 0.54
CA2 P00918 3/20 0.54
CA9 Q16790 3/20 0.54
HTR6 P50406 1/20 0.44
LARS1 Q9P2J5 1/20 0.41
TSHR P16473 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
CA3 P07451 1/20 0.41
CA4 P22748 1/20 0.41
CA6 P23280 1/20 0.41
CA5A P35218 1/20 0.41
CA7 P43166 1/20 0.41
PLA2G7 Q13093 1/20 0.41
CA13 Q8N1Q1 1/20 0.41
CA14 Q9ULX7 1/20 0.41
CA5B Q9Y2D0 1/20 0.41
LMNA P02545 1/20 0.41
HSD17B10 Q99714 1/20 0.41
KDM4E B2RXH2 1/20 0.39

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
SCHEMBL8189066 0.85 SOS1 (0.53) CA12CA1CA2CA9SMN1; SMN2
SCHEMBL1200588 0.83 CA1 (0.53) CA12CA1CA2CA9HTR6
SCHEMBL3442045 0.82 CA1 (0.56) CA12CA1CA2CA9CA3
SCHEMBL3541639 0.82 LMNA (0.58) CA12CA1CA2CA9HTR6
SCHEMBL16884985 0.82 CA12 (0.51) CA12CA1CA2CA9HTR6
SCHEMBL28327825 0.80 NLRP3 (0.45) ALDH1A1MAPT
SCHEMBL8959071 0.80 CA2 (0.54) CA12CA1CA2CA9HTR6
SCHEMBL27933104 0.80 CA12 (0.50) CA12CA1CA2CA9HTR6
SCHEMBL27751149 0.79 CA12 (0.61) CA12CA1CA2CA9LARS1
SCHEMBL28104760 0.79 CA12 (0.50) CA12CA1CA2CA9LARS1

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 50 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2461683-A1 BICYCLIC ARYL SPHINGOSINE 1-PHOSPHATE ANALOGS Biogen Idec MA Inc. (US) 2012-06-13 EP claimed
WO-2011017561-A1 BICYCLIC ARYL SPHINGOSINE 1-PHOSPHATE ANALOGS BIOGEN IDEC MA INC. (US) 2011-02-10 WO claimed
EP-1670804-A2 HETEROBICYCLIC COMPOUNDS AS PHARMACEUTICALLY ACTIVE AGENTS GPC Biotech AG (DE) 2006-06-21 EP claimed
WO-2005023818-A2 HETEROBICYCLIC COMPOUNDS AS PHARMACEUTICALLY ACTIVE AGENTS GPC BIOTECH AG (DE) 2005-03-17 WO claimed
US-4948879-A Monoazo compounds containing a fiber-reactive group and an oxazolopyridone or oxazinopyridone coupling component HOECHST AKTIENGESELLSCHAFT (DE) 1990-08-14 US claimed
US-10233152-B2 LSD1 inhibitors Mirati Therapeutics, Inc. (US) 2019-03-19 US disclosed
US-20180127369-A1 LSD1 Inhibitors Mirati Therapeutics, Inc. 2018-05-10 US disclosed
EP-3038618-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS Vanderbilt University (US) 2016-07-06 EP disclosed
US-9150556-B2 Benzimidazolone chymase inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2015-10-06 US disclosed
WO-2015031608-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS VANDERBILT UNIVERSITY (US) 2015-03-05 WO disclosed
US-20100240702-A1 Benzimidazolone Chymase Inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-09-23 US disclosed
US-7727997-B2 N,N′-substituted-1,3-diamino-2-hydroxypropane derivatives ELAN PHARMACEUTICALS, INC. (US) 2010-06-01 US disclosed
EP-0316779-A2 Pyridone azo compounds, process for their preparation and their use as dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1989-05-24 EP disclosed
US-4559059-A REACTIVE DYES BONDED TO POLYMER CIBA-GEIGY CORPORATION (US) 1985-12-17 US disclosed
US-4553975-A REACTING A DYE WITH COPOLYMER GEL CIBA GEIGY CORPORATION (US) 1985-11-19 US disclosed
US-4468229-A Tinted contact lenses and a method for their preparation with reactive dyes CIBA-GEIGY CORPORATION (US) 1984-08-28 US disclosed
US-4314812-A Two-phase printing process for preparing conversion articles and discharge resist prints HOECHST AKTIENGESELLSCHAFT (DE) 1982-02-09 US disclosed
US-4314811-A Two-phase printing process for preparing conversion articles and discharge resist prints HOECHST AKTIENGESELLSCHAFT (DE) 1982-02-09 US disclosed
EP-0030786-A2 Textile colouration process and textiles coloured thereby IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1981-06-24 EP disclosed
US-4092101-A Process for fixing prints with reactive dyestuffs on textile materials of native or regenerated cellulose and mixtures thereof with synthetic fibers HOECHST AKTIENGESELLSCHAFT (DT) 1978-05-30 US 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 (3 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-10233152-B2 LSD1 inhibitors KDM1B, KDM1A, KDM3A CA12 4254/4885CA1 3109/4885CA2 1946/4885
US-20100240702-A1 Benzimidazolone Chymase Inhibitors CMA1, SERPINB1, CPA3 CA12 2383/4885CA1 3632/4885CA2 743/4885
US-20180127369-A1 LSD1 Inhibitors KDM1B, KDM1A, KDM3A CA12 4254/4885CA1 3109/4885CA2 1946/4885

“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.