SCHEMBL7951731

SCHEMBL7951731

COc1ccc2[nH]cc(Cc3nn(CC(=O)O)c(=O)c4ccccc34)c2c1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ GPR84 Q9NQS5 2/20 0.56
▸ KDM4E B2RXH2 1/20 0.55
▸ CMA1 P23946 3/20 0.53
▸ TSHR P16473 1/20 0.53
▸ S1PR2 O95136 2/20 0.51
▸ ALOX15 P16050 1/20 0.51
▸ MTNR1B P49286 3/20 0.51
▸ KMT2A Q03164 2/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ MTNR1A P48039 2/20 0.48
▸ AHR P35869 1/20 0.48
▸ FAAH O00519 1/20 0.48

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
SCHEMBL7962204 0.90 CYP1A2 (0.59) GPR84KDM4EMTNR1BKMT2AMEN1
SCHEMBL18900946 0.89 GPR84 (0.59) GPR84KDM4EMTNR1BKMT2AMEN1
SCHEMBL7967791 0.87 CMA1 (0.56) CMA1TSHRS1PR2ALOX15KMT2A
SCHEMBL7960283 0.85 CMA1 (0.65) GPR84CMA1TSHRS1PR2ALOX15
SCHEMBL18900933 0.83 TSHR (0.55) CMA1TSHRS1PR2ALOX15KMT2A
SCHEMBL6115415 0.77 CMA1 (0.56) GPR84KDM4ECMA1TSHRALOX15
SCHEMBL7963792 0.77 CYP1A2 (0.68) KDM4ECMA1TSHRS1PR2ALOX15
SCHEMBL24076972 0.76 ALOX15 (0.65) KDM4ECMA1TSHRS1PR2ALOX15
SCHEMBL18900944 0.74 MAPT (0.53) GPR84CMA1TSHRALOX15KMT2A
SCHEMBL674415 0.72 KDM4E (1.00) GPR84KDM4ETSHRMTNR1BKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2323991-B1 CHYMASE INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2017-05-31 — — EP disclosed
EP-2323991-B1 CHYMASE INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2017-05-31 — — EP disclosed
US-8969348-B2 Chymase inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2015-03-03 — — US disclosed
US-8969348-B2 Chymase inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2015-03-03 — — US disclosed
US-20120129863-A1 CHYMASE INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-05-24 — — US disclosed
US-20120129863-A1 CHYMASE INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-05-24 — — US disclosed
WO-2010019417-A2 CHYMASE INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-02-18 — — 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 (1 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-20120129863-A1 CHYMASE INHIBITORS CMA1, CPA3, SERPINB1 GPR84 3124/4885KDM4E 3953/4885CMA1 1/4885

“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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