SCHEMBL6132376

SCHEMBL6132376

COCCCCCCOC1CCN(c2ccc(-c3nnc(-c4ccc(C(=O)O)cc4)s3)cc2)CC1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CSNK2A2 P19784 12/20 0.46
CSNK2A1 P68400 12/20 0.46
USP2 O75604 2/20 0.44
NR1H4 Q96RI1 1/20 0.42
CSNK2B P67870 1/20 0.39
PPARA Q07869 1/20 0.39
HRH3 Q9Y5N1 1/20 0.38
RARB P10826 1/20 0.38
CHEK1 O14757 1/20 0.38
ALDH1A1 P00352 1/20 0.37

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
Hydrochloric Acid SCHEMBL6132312 0.99 CSNK2A2 (0.45) CSNK2A2CSNK2A1USP2NR1H4CSNK2B
Hydrochloric Acid SCHEMBL6134979 0.99 CSNK2A2 (0.45) CSNK2A2CSNK2A1USP2NR1H4CSNK2B
Hydrochloric Acid SCHEMBL6134551 0.94 CSNK2A2 (0.43) CSNK2A2CSNK2A1USP2NR1H4CSNK2B
SCHEMBL6132272 0.91 ALDH1A1 (0.41) CSNK2A2CSNK2A1USP2HRH3ALDH1A1
SCHEMBL6132291 0.91 ALDH1A1 (0.41) CSNK2A2CSNK2A1USP2HRH3ALDH1A1
SCHEMBL6934067 0.91 ALDH1A1 (0.41) CSNK2A2CSNK2A1USP2HRH3ALDH1A1
SCHEMBL6134390 0.91 CSNK2A2 (0.53) CSNK2A2CSNK2A1USP2NR1H4CSNK2B
SCHEMBL6132358 0.91 CSNK2A2 (0.42) CSNK2A2CSNK2A1USP2NR1H4HRH3
SCHEMBL6132483 0.91 CSNK2A2 (0.42) CSNK2A2CSNK2A1USP2NR1H4HRH3
SCHEMBL6135503 0.90 CSNK2A2 (0.52) CSNK2A2CSNK2A1USP2NR1H4CSNK2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6884774-B2 Cyclic hexapeptide derivatives FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2005-04-26 US disclosed
EP-1259535-B1 CYCLIC HEXAPEPTIDE DERIVATIVES FUJISAWA PHARMACEUTICAL CO (JP) 2005-04-13 EP disclosed
US-20030083238-A1 Cyclic hexapeptide derivatives ASTELLAS PHARMA INC. (JP) 2003-05-01 US disclosed
EP-1259535-A1 CYCLIC HEXAPEPTIDE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-11-27 EP disclosed
WO-2001060846-A1 CYCLIC HEXAPEPTIDE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-08-23 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-20030083238-A1 Cyclic hexapeptide derivatives NGLY1, ALG1, CHIT1 CSNK2A2 1792/4885CSNK2A1 1184/4885USP2 4462/4885

“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.