SCHEMBL10074455

SCHEMBL10074455

CCCCCCCC(=O)NC(CC(=O)NCC(C)(C)CNC(=O)C(O)C(COCc1ccccc1)NC(=O)CCCCCCC)Cc1cc(F)ccc1F

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 1/20 0.39
LPAR1 Q92633 5/20 0.38
LPAR3 Q9UBY5 4/20 0.38
HDAC1 Q13547 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
PSMB5 P28074 1/20 0.36
CTSS P25774 1/20 0.35
SMPD2 O60906 1/20 0.34
SMPD1 P17405 1/20 0.34

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
SCHEMBL10074987 1.00 ENPP2 (0.39) ENPP2LPAR1LPAR3HDAC1HDAC6
SCHEMBL10074154 0.99 ENPP2 (0.38) ENPP2LPAR1LPAR3HDAC1HDAC6
SCHEMBL10074135 0.94 CTSS (0.35) PSMB5CTSS
SCHEMBL10077372 0.92 ENPP2 (0.38) ENPP2LPAR1LPAR3HDAC1HDAC6
SCHEMBL6875612 0.92 ENPP2 (0.42) ENPP2LPAR1LPAR3HDAC1HDAC6
SCHEMBL6874881 0.92 ENPP2 (0.42) ENPP2LPAR1LPAR3HDAC1HDAC6
SCHEMBL10075000 0.92 LPAR1 (0.36) ENPP2LPAR1LPAR3HDAC1HDAC6
SCHEMBL12291363 0.91 ENPP2 (0.41) ENPP2LPAR1LPAR3HDAC1HDAC6
SCHEMBL10074273 0.88 CTSD (0.33) ENPP2CTSS
SCHEMBL10078261 0.88 PSMB11 (0.38) PSMB5CTSS

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
EP-2418196-A1 Dual alanyl-aminopeptidase and dipeptidyl-peptidase IV inhibitors IMTM GmbH (DE) 2012-02-15 EP disclosed
US-20120028995-A1 NOVEL COMPOUNDS FOR MEDICAL USE AS PEPTIDASE EFFECTORS IMTM GMBH (DE) 2012-02-02 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-20120028995-A1 NOVEL COMPOUNDS FOR MEDICAL USE AS PEPTIDASE EFFECTORS SERPINB1, CMA1, CPA3 ENPP2 134/4885LPAR1 2015/4885LPAR3 2390/4885

“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.