SCHEMBL13727489

SCHEMBL13727489

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

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ RXFP1 Q9HBX9 2/20 0.58
▸ DEGS1 O15121 2/20 0.58
▸ VNN1 O95497 4/20 0.53
▸ LMNA P02545 2/20 0.51
▸ ALDH1A1 P00352 1/20 0.51
▸ MEN1 O00255 4/20 0.49
▸ KMT2A Q03164 4/20 0.49
▸ RAB9A P51151 2/20 0.49
▸ P4HTM Q9NXG6 1/20 0.49
▸ NPC1 O15118 1/20 0.49
▸ F2 P00734 1/20 0.49
▸ MAPT P10636 1/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ NPSR1 Q6W5P4 1/20 0.49
▸ HPGD P15428 1/20 0.49

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
SCHEMBL4074720 0.84 DEGS1 (0.55) RXFP1DEGS1LMNAALDH1A1MEN1
Hydrochloric Acid SCHEMBL38658381 0.83 DEGS1 (0.54) RXFP1DEGS1LMNAALDH1A1MEN1
SCHEMBL13728656 0.82 DEGS1 (0.52) RXFP1DEGS1LMNAALDH1A1MEN1
SCHEMBL13838614 0.82 RXFP1 (0.52) RXFP1DEGS1VNN1LMNAALDH1A1
SCHEMBL13728652 0.82 DEGS1 (0.52) RXFP1DEGS1LMNAALDH1A1MEN1
SCHEMBL8590143 0.76 HCAR3 (0.53) DEGS1RAB9AMAPT
SCHEMBL15067437 0.75 RXFP1 (0.65) RXFP1VNN1LMNAALDH1A1MEN1
SCHEMBL9418310 0.75 RXFP1 (0.79) RXFP1LMNAALDH1A1MEN1KMT2A
SCHEMBL51509 0.75 RXFP1 (0.79) RXFP1LMNAALDH1A1MEN1KMT2A
SCHEMBL11584100 0.73 HCAR3 (0.68) DEGS1LMNAALDH1A1RAB9AP4HTM

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 6 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-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
EP-2704701-A1 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES Synta Pharmaceuticals Corp. (US) 2014-03-12 — — EP 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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