SCHEMBL6115031

SCHEMBL6115031

CC(=O)On1nc(Cc2cccc3ccccc23)c2ccccc2c1=O

nearest known ligand 0.63

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CMA1 P23946 5/20 0.61
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ P2RX3 P56373 2/20 0.44
▸ LMNA P02545 1/20 0.42
▸ HPGD P15428 1/20 0.42
▸ MTNR1A P48039 1/20 0.40
▸ IDH1 O75874 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ CYP1A2 P05177 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ ALDH1A1 P00352 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
SCHEMBL6115861 0.80 AHR (0.45) SMN1; SMN2LMNAHPGDTSHRCYP1A2
SCHEMBL6115028 0.76 CMA1 (1.00) CMA1LMNAHPGDTSHRCYP1A2
SCHEMBL18900851 0.76 CMA1 (0.72) CMA1SMN1; SMN2LMNAHPGDTSHR
SCHEMBL7963507 0.74 CMA1 (0.73) CMA1SMN1; SMN2LMNAHPGDTSHR
SCHEMBL6115916 0.74 CMA1 (0.81) CMA1SMN1; SMN2P2RX3LMNAHPGD
SCHEMBL30451982 0.73 KDM4E (0.50) SMN1; SMN2LMNATSHRL3MBTL1
SCHEMBL7962647 0.73 CMA1 (0.78) CMA1SMN1; SMN2P2RX3LMNAHPGD
SCHEMBL7960570 0.72 CMA1 (1.00) CMA1SMN1; SMN2P2RX3TSHR
SCHEMBL1852376 0.72 CMA1 (0.60) CMA1SMN1; SMN2P2RX3LMNAHPGD
SCHEMBL1849731 0.71 CMA1 (0.79) CMA1SMN1; SMN2P2RX3LMNACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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 1/4885SMN1; SMN2 1912/4885P2RX3 2200/4885

“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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