SCHEMBL172392

SCHEMBL172392

CS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 6/20 0.58
TSHR P16473 2/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
PTGS2 P35354 1/20 0.53
POLB P06746 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
NOTUM Q6P988 1/20 0.51
MEP1B Q16820 1/20 0.51
LMNA P02545 2/20 0.50
KIF11 P52732 1/20 0.50
HSD17B10 Q99714 1/20 0.48
CNR2 P34972 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA7 P43166 1/20 0.48
CA9 Q16790 1/20 0.48
ALDH1A1 P00352 1/20 0.47
LRRK2 Q5S007 1/20 0.46

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
SCHEMBL12560325 0.85 KIF11 (0.54) CCR2TSHRSMN1; SMN2PTGS2NOTUM
SCHEMBL6209362 0.85 MEP1B (0.54) CCR2TSHRSMN1; SMN2POLBL3MBTL1
SCHEMBL29989656 0.83 MEP1B (0.52) CCR2TSHRSMN1; SMN2POLBL3MBTL1
SCHEMBL127681 0.83 MEP1B (0.52) CCR2TSHRSMN1; SMN2POLBL3MBTL1
SCHEMBL14632300 0.82 CCR2 (0.60) CCR2TSHRSMN1; SMN2POLBL3MBTL1
SCHEMBL2952580 0.81 CA2 (0.62) CCR2TSHRSMN1; SMN2PTGS2POLB
SCHEMBL10763658 0.81 MEP1B (0.55) CCR2TSHRSMN1; SMN2POLBL3MBTL1
SCHEMBL14600358 0.81 CCR2 (0.51) CCR2TSHRSMN1; SMN2POLBL3MBTL1
SCHEMBL12413877 0.81 POLB (0.59) CCR2TSHRSMN1; SMN2POLBL3MBTL1
SCHEMBL3578432 0.80 G6PD (0.51) CCR2TSHRSMN1; SMN2PTGS2KIF11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2951169-B1 FLAP MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2019-08-28 EP disclosed
US-9926333-B2 Flap modulators JANSSEN PHARMACEUTICA NV (BE) 2018-03-27 US disclosed
US-20170327514-A1 FLAP MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2017-11-16 US disclosed
US-9732093-B2 FLAP modulators JANSSEN PHARMACEUTICA NV (BE) 2017-08-15 US disclosed
US-20150368270-A1 FLAP MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2015-12-24 US disclosed
US-9169251-B2 Pyrrolopyridine derivatives and their use as CRTH2 antagonists NOVARTIS AG (CH) 2015-10-27 US disclosed
US-9169251-B2 Pyrrolopyridine derivatives and their use as CRTH2 antagonists NOVARTIS AG (CH) 2015-10-27 US disclosed
US-20150252008-A1 FLAP MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2015-09-10 US disclosed
US-9073876-B2 Flap modulators JANSSEN PHARMACEUTICA NV (BE) 2015-07-07 US disclosed
US-20140309254-A1 PYRROLOPYRIDINE DERIVATIVES AND THEIR USE AS CRTH2 ANTAGONISTS NOVARTIS AG 2014-10-16 US disclosed
US-8455645-B2 Pyrrolopyridine derivatives and their use as CRTH2 antagonists NOVARTIS AG (CH) 2013-06-04 US disclosed
EP-2175859-B1 FUSED HETEROARYL PYRIDYL AND PHENYL BENZENESULFONAMIDES AS CCR2 MODULATORS FOR THE TREAMENT OF INFLAMMATION CHEMOCENTRYX INC (US) 2012-03-07 EP disclosed
EP-2406230-A1 SUBSTITUTED INDAZOLE AMIDES AND THEIR USE AS GLUCOKINASE ACTIVATORS Pfizer Inc. (US) 2012-01-18 EP disclosed
US-20110319379-A1 Substituted Indazole Amides And Their Use As Glucokinase Activators CORBETT JEFFREY W (US) 2011-12-29 US disclosed
WO-2010103438-A1 SUBSTITUTED INDAZOLE AMIDES AND THEIR USE AS GLUCOKINASE ACTIVATORS PFIZER INC. (US) 2010-09-16 WO disclosed
US-20100210610-A1 Organic compounds BALA KAMLESH JAGDIS 2010-08-19 US disclosed
US-20100204225-A1 Organic compounds BALA KAMLESH JAGDIS 2010-08-12 US disclosed
US-7666878-B2 (1-Benzyl-2-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-acetic acid; chemoattractant receptor-homologous molecule expressed on helper T-cells antagonist; antiinflammatory agent, antiallergen; obstructive airways disease NOVARTIS AG (CH) 2010-02-23 US disclosed
US-20080312230-A1 Organic Compounds NOVARTIS AG 2008-12-18 US disclosed
US-20080114022-A1 (1-Benzyl-2-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-acetic acid; chemoattractant receptor-homologous molecule expressed on helper T-cells antagonist; antiinflammatory agent, antiallergen; obstructive airways disease NOVARTIS AG (CH) 2008-05-15 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 (9 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-20140309254-A1 PYRROLOPYRIDINE DERIVATIVES AND THEIR USE AS CRTH2 ANTAGONISTS HRH2, QDPR, AVPR2 CCR2 950/4885TSHR 246/4885SMN1; SMN2 3154/4885
US-20100210610-A1 Organic compounds SLC10A6, SLCO1B3, OPRM1 CCR2 1770/4885TSHR 1209/4885SMN1; SMN2 2904/4885
US-20080114022-A1 (1-Benzyl-2-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-acetic acid; chemoattractant receptor-homologous molecule expressed on helper T-cells antagonist; antiinflammatory agent, antiallergen; obstructive airways disease CCR1, CCL2, CCL11 CCR2 6/4885TSHR 949/4885SMN1; SMN2 3972/4885
US-20170327514-A1 FLAP MODULATORS FEN1, PGF, TBXA2R CCR2 1727/4885TSHR 2773/4885SMN1; SMN2 3013/4885
US-20100204225-A1 Organic compounds SLC10A6, SLCO1B3, OPRM1 CCR2 1770/4885TSHR 1209/4885SMN1; SMN2 2904/4885
US-20150368270-A1 FLAP MODULATORS FEN1, PGF, TBXA2R CCR2 1727/4885TSHR 2773/4885SMN1; SMN2 3013/4885
US-20110319379-A1 Substituted Indazole Amides And Their Use As Glucokinase Activators GCKR, GCK, GALK1 CCR2 4078/4885TSHR 1402/4885SMN1; SMN2 4298/4885
US-20080312230-A1 Organic Compounds OPRM1, OPRL1, OPRD1 CCR2 1117/4885TSHR 1448/4885SMN1; SMN2 340/4885
US-20150252008-A1 FLAP MODULATORS FEN1, PGF, PTGIS CCR2 1421/4885TSHR 3351/4885SMN1; SMN2 3325/4885

“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.