SCHEMBL5570968

SCHEMBL5570968

Cc1nc2c3c(c(C(=O)N(C)C)cn2c1C)CC[C@@H](c1cccs1)O3

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.35
CYP3A4 P08684 1/20 0.30
CYP2C9 P11712 1/20 0.30
ATP4A P20648 1/20 0.30
ATP4B P51164 1/20 0.30
SLC22A12 Q96S37 1/20 0.30

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
SCHEMBL5566631 1.00 KDM4E (0.35) KDM4ECYP3A4CYP2C9ATP4AATP4B
SCHEMBL5567312 0.85 ATP4A (0.43) KDM4ECYP3A4CYP2C9ATP4AATP4B
SCHEMBL4888725 0.85 ATP4A (0.43) KDM4ECYP3A4CYP2C9ATP4AATP4B
SCHEMBL5566826 0.85 ATP4A (0.43) KDM4ECYP3A4CYP2C9ATP4AATP4B
SCHEMBL5566402 0.83 CYP3A4 (0.33) CYP3A4CYP2C9ATP4AATP4B
SCHEMBL5569799 0.83 CYP3A4 (0.33) CYP3A4CYP2C9ATP4AATP4B
SCHEMBL5571355 0.83 CYP3A4 (0.33) CYP3A4CYP2C9ATP4AATP4B
SCHEMBL5569811 0.82 RIPK1 (0.41) CYP3A4CYP2C9ATP4AATP4B
SCHEMBL5570783 0.82 RIPK1 (0.41) CYP3A4CYP2C9ATP4AATP4B
SCHEMBL5570722 0.81 ATP4A (0.35) KDM4ECYP3A4CYP2C9ATP4AATP4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070066674-A1 Tricyclic imidzopyridines for use as gastric secretion inhibitors ALTANA PHARMA AG (DE) 2007-03-22 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-20070066674-A1 Tricyclic imidzopyridines for use as gastric secretion inhibitors GIPR, SLC10A2, GRPR KDM4E 4244/4885CYP3A4 72/4885CYP2C9 110/4885

“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.