SCHEMBL1851671

SCHEMBL1851671

CCCC(C(=O)O)n1nc(Cc2cccc3ccccc23)c2ccccc2c1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CMA1 P23946 8/20 1.00
▸ POLB P06746 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ P2RX3 P56373 1/20 0.42
▸ IDH1 O75874 1/20 0.41
▸ SRC P12931 2/20 0.41
▸ ABL1 P00519 1/20 0.41
▸ HCK P08631 1/20 0.41
▸ ALOX15 P16050 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.39

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
SCHEMBL1849731 0.89 CMA1 (0.79) CMA1POLBSMN1; SMN2P2RX3
SCHEMBL7960524 0.82 CMA1 (1.00) CMA1POLBKDM4E
SCHEMBL7960570 0.82 CMA1 (1.00) CMA1POLBSMN1; SMN2P2RX3SRC
SCHEMBL6115243 0.80 CMA1 (0.70) CMA1POLBKDM4E
SCHEMBL7951279 0.80 CMA1 (1.00) CMA1
SCHEMBL18900937 0.78 CMA1 (0.73) CMA1POLBSMN1; SMN2P2RX3IDH1
SCHEMBL1851788 0.78 CMA1 (0.64) CMA1POLBALOX15KDM4E
SCHEMBL7962647 0.77 CMA1 (0.78) CMA1POLBSMN1; SMN2P2RX3SRC
SCHEMBL6115536 0.76 CMA1 (0.65) CMA1POLBKDM4E
SCHEMBL1850267 0.76 CMA1 (0.61) CMA1POLBSMN1; SMN2KDM4E

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 10 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-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
US-20120129863-A1 CHYMASE INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-05-24 — — US disclosed
EP-2323991-A2 CHYMASE INHIBITORS Boehringer Ingelheim International GmbH (DE) 2011-05-25 — — EP 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 CMA1 1/4885POLB 2228/4885SMN1; SMN2 1912/4885

“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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