SCHEMBL13838614

SCHEMBL13838614

COc1ccc(C(=O)c2ccc(NC(=O)OC(C)(C)C)nc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ RXFP1 Q9HBX9 1/20 0.52
▸ DEGS1 O15121 2/20 0.52
▸ VNN1 O95497 5/20 0.48
▸ PPARG P37231 1/20 0.47
▸ PPARA Q07869 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.46
▸ LMNA P02545 1/20 0.46
▸ ELANE P08246 1/20 0.44
▸ NPC1 O15118 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ F2 P00734 1/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ GRIN2B Q13224 1/20 0.44

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
SCHEMBL8228538 0.86 DEGS1 (0.49) DEGS1ALDH1A1LMNANPC1RAB9A
SCHEMBL13838595 0.85 DEGS1 (0.48) RXFP1DEGS1PPARGALDH1A1LMNA
SCHEMBL15803785 0.84 DEGS1 (0.47) RXFP1DEGS1PPARGALDH1A1LMNA
SCHEMBL2772417 0.82 MAPK1 (0.51) DEGS1ALDH1A1GRIN2B
SCHEMBL13727489 0.82 RXFP1 (0.58) RXFP1DEGS1VNN1ALDH1A1LMNA
SCHEMBL29651977 0.81 HCAR3 (0.57) GRIN2B
SCHEMBL28658285 0.81 GRIN2B (0.48) DEGS1ALDH1A1LMNANPC1RAB9A
SCHEMBL2877186 0.81 HCAR3 (0.57) GRIN2B
SCHEMBL31727242 0.81 GRIN2B (0.48) DEGS1ALDH1A1LMNANPC1RAB9A
SCHEMBL7936803 0.80 HCAR3 (0.55) GRIN2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10399967-B2 Compounds for inflammation and immune-related uses PRCL Research Inc. (CA) 2019-09-03 — — US disclosed
US-20170231984-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES PRCL Research Inc. (CA) 2017-08-17 — — US disclosed
US-20170231984-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES PRCL Research Inc. (CA) 2017-08-17 — — US disclosed
US-9604978-B2 Compounds for inflammation and immune-related uses SYNTA PHARMACEUTICALS CORP. (US) 2017-03-28 — — US disclosed
US-9604978-B2 Compounds for inflammation and immune-related uses SYNTA PHARMACEUTICALS CORP. (US) 2017-03-28 — — US disclosed
US-20140171446-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2014-06-19 — — US disclosed
US-20140171446-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2014-06-19 — — US disclosed
CN-103702665-A Compounds for inflammation and immune-related uses SYNTA PHARMACEUTICALS CORP 2014-04-02 — — CN disclosed
WO-2012151355-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2012-11-08 — — 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 (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-20140171446-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES CXCL8, CCR1, CCR8 RXFP1 1391/4885DEGS1 3448/4885VNN1 1573/4885
US-10399967-B2 Compounds for inflammation and immune-related uses CXCL8, CCR1, CCR8 RXFP1 1391/4885DEGS1 3448/4885VNN1 1573/4885
US-20170231984-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES CXCL8, CCR1, CCR8 RXFP1 1391/4885DEGS1 3448/4885VNN1 1573/4885

“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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