SCHEMBL7962204

SCHEMBL7962204

CCOC(=O)Cn1nc(Cc2c[nH]c3ccc(OC)cc23)c2ccccc2c1=O

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 1/20 0.59
▸ CYP3A4 P08684 1/20 0.59
▸ CYP2C9 P11712 1/20 0.59
▸ CYP2C19 P33261 1/20 0.59
▸ L3MBTL1 Q9Y468 1/20 0.59
▸ GPR84 Q9NQS5 2/20 0.51
▸ GAA P10253 1/20 0.48
▸ RECQL P46063 1/20 0.48
▸ MTNR1B P49286 2/20 0.47
▸ AHR P35869 2/20 0.46
▸ KDM4E B2RXH2 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ MTNR1A P48039 2/20 0.45
▸ POLB P06746 1/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ PKM P14618 1/20 0.43

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
SCHEMBL7951731 0.90 GPR84 (0.56) GPR84MTNR1BAHRKDM4EMTNR1A
SCHEMBL7963792 0.89 CYP1A2 (0.68) CYP1A2CYP3A4CYP2C9CYP2C19L3MBTL1
SCHEMBL18900946 0.87 GPR84 (0.59) GPR84MTNR1BAHRKDM4EMTNR1A
SCHEMBL8739236 0.82 CMA1 (0.61) CYP1A2CYP3A4CYP2C9CYP2C19L3MBTL1
SCHEMBL24076242 0.80 CYP2C19 (0.58) CYP1A2CYP3A4CYP2C9CYP2C19L3MBTL1
SCHEMBL7967791 0.79 CMA1 (0.56) CYP1A2CYP3A4CYP2C9CYP2C19L3MBTL1
SCHEMBL18900933 0.76 TSHR (0.55) CYP1A2CYP3A4CYP2C9CYP2C19L3MBTL1
SCHEMBL7963507 0.76 CMA1 (0.73) CYP1A2CYP3A4CYP2C9CYP2C19L3MBTL1
SCHEMBL7960283 0.75 CMA1 (0.65) CYP1A2CYP3A4CYP2C9CYP2C19L3MBTL1
SCHEMBL24076900 0.75 CYP1A2 (0.77) CYP1A2CYP3A4CYP2C9CYP2C19L3MBTL1

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
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 CYP1A2 2423/4885CYP3A4 2760/4885CYP2C9 1552/4885

“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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