SCHEMBL1823693

SCHEMBL1823693

COc1ccc(Cl)cc1-c1ccc(NC(=O)c2ccncc2F)cc1

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ORAI1 Q96D31 2/20 0.81
▸ STIM1 Q13586 1/20 0.81
▸ KCNMA1 Q12791 1/20 0.66
▸ ALDH1A1 P00352 4/20 0.58
▸ MEN1 O00255 2/20 0.56
▸ KMT2A Q03164 2/20 0.56
▸ HSD17B10 Q99714 3/20 0.54
▸ ALOX15 P16050 1/20 0.54
▸ CASP1 P29466 1/20 0.54
▸ CASP7 P55210 1/20 0.54
▸ MAPT P10636 5/20 0.53
▸ NPSR1 Q6W5P4 2/20 0.53
▸ GAA P10253 1/20 0.53
▸ HTT P42858 1/20 0.53
▸ NPC1 O15118 5/20 0.52
▸ POLB P06746 1/20 0.52
▸ AHR P35869 1/20 0.52
▸ HPGD P15428 3/20 0.51
▸ KDM4E B2RXH2 1/20 0.51
▸ LCLAT1 Q6UWP7 1/20 0.51

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
SCHEMBL29706899 0.89 ORAI1 (1.00) ORAI1STIM1KCNMA1MEN1KMT2A
SCHEMBL1829334 0.89 ORAI1 (1.00) ORAI1STIM1KCNMA1MEN1KMT2A
SCHEMBL1825942 0.88 KCNMA1 (0.64) ORAI1STIM1KCNMA1ALDH1A1MEN1
SCHEMBL16363185 0.88 ORAI1 (0.78) ORAI1STIM1KCNMA1ALDH1A1MEN1
SCHEMBL1828476 0.88 STIM1 (0.63) ORAI1STIM1KCNMA1ALDH1A1MEN1
SCHEMBL4761818 0.85 ORAI1 (0.65) ORAI1STIM1KCNMA1ALDH1A1MEN1
SCHEMBL2784233 0.84 ORAI1 (0.58) ORAI1STIM1KCNMA1ALDH1A1MEN1
SCHEMBL1827167 0.83 ALDH1A1 (0.60) ORAI1STIM1KCNMA1ALDH1A1MEN1
SCHEMBL1825721 0.81 ALDH1A1 (0.57) ORAI1STIM1KCNMA1ALDH1A1MEN1
SCHEMBL8296803 0.79 IL2 (0.56) ORAI1STIM1KCNMA1ALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150005320-A9 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2015-01-01 — — US disclosed
US-20150005320-A9 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2015-01-01 — — US disclosed
US-20140107134-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2014-04-17 — — US disclosed
US-20140107134-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2014-04-17 — — US disclosed
EP-2319516-A1 Compounds for treating inflammatory and autoimmune disorders Synta Pharmaceuticals Corp. (US) 2011-05-11 — — EP disclosed
EP-2319516-A1 Compounds for treating inflammatory and autoimmune disorders Synta Pharmaceuticals Corp. (US) 2011-05-11 — — EP disclosed
WO-2005009954-A2 METHOD FOR MODULATING CALCIUM ION-RELEASE-ACTIVATED CALCIUM ION CHANNELS SYNTA PHARMACEUTICALS, CORP. (US) 2005-02-03 — — WO disclosed
WO-2005009539-A2 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS, CORP. (US) 2005-02-03 — — 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-20140107134-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES CXCR2, CXCL8, CCR9 ORAI1 1379/4885STIM1 2320/4885KCNMA1 2604/4885
US-20150005320-A9 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES CXCR2, CXCL8, CCR9 ORAI1 1379/4885STIM1 2320/4885KCNMA1 2604/4885

“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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