SCHEMBL8263207

SCHEMBL8263207

COc1ccc(-c2cnco2)cc1-c1ccc(NC(=O)c2snnc2C)cc1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ IMPDH2 P12268 16/20 0.48
▸ LMNA P02545 2/20 0.47
▸ IMPDH1 P20839 2/20 0.46
▸ STIM1 Q13586 1/20 0.44
▸ ORAI1 Q96D31 1/20 0.44
▸ KDM4E B2RXH2 1/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ PKM P14618 1/20 0.43
▸ RAB9A P51151 1/20 0.43

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
SCHEMBL2812854 0.89 ABCB1 (0.41) IMPDH2LMNAIMPDH1KDM4ENPC1
SCHEMBL8233638 0.86 LMNA (0.59) IMPDH2LMNAIMPDH1ORAI1KDM4E
SCHEMBL16456511 0.85 IMPDH2 (0.44) IMPDH2IMPDH1
SCHEMBL1827209 0.83 ORAI1 (0.56) LMNASTIM1ORAI1NPC1ALDH1A1
SCHEMBL16363177 0.81 LMNA (0.52) LMNASTIM1ORAI1KDM4EALDH1A1
SCHEMBL1828387 0.81 LMNA (0.52) LMNASTIM1ORAI1KDM4ENPC1
SCHEMBL15463155 0.79 IMPDH2 (0.47) IMPDH2LMNAIMPDH1KDM4ENPC1
SCHEMBL8263206 0.78 IL2 (0.53) IMPDH2LMNAIMPDH1STIM1ORAI1
SCHEMBL6127884 0.78 IL2 (0.54) LMNAALDH1A1
SCHEMBL2816136 0.77 LMNA (0.41) IMPDH2LMNAKDM4ENPC1PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140039009-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2014-02-06 — — US disclosed
US-20120225883-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2012-09-06 — — US disclosed
US-8202999-B2 biphenyl and pyridylphenyl derivatives such as 2,6-Difluoro-N-[2'-methyl-5'-(pyridine-3-yl)-biphenyl-4-yl]-benzamide, used as immunosuppressants for the treatmet or prevent allergies, inflammatory and immune disorders SYNTA PHARMACEUTICALS CORP. (US) 2012-06-19 — — US disclosed
US-8202999-B2 biphenyl and pyridylphenyl derivatives such as 2,6-Difluoro-N-[2'-methyl-5'-(pyridine-3-yl)-biphenyl-4-yl]-benzamide, used as immunosuppressants for the treatmet or prevent allergies, inflammatory and immune disorders SYNTA PHARMACEUTICALS CORP. (US) 2012-06-19 — — US disclosed
WO-2006083477-A2 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2006-08-10 — — 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-20120225883-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES CXCL8, CCR8, CXCR2 IMPDH2 4054/4885LMNA 3080/4885IMPDH1 3403/4885
US-20140039009-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES CXCL8, CCR8, CXCR2 IMPDH2 4054/4885LMNA 3080/4885IMPDH1 3403/4885

“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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