SCHEMBL6481998

SCHEMBL6481998

CC(c1c[nH]c2ccccc12)C(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MDM4 O15151 2/20 0.46
TP53 P04637 2/20 0.46
CASP3 P42574 4/20 0.45
PIN1 Q13526 2/20 0.45
KMT2A Q03164 1/20 0.43
MDM2 Q00987 2/20 0.42

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
SCHEMBL6480706 1.00 MDM4 (0.46) MDM4TP53CASP3PIN1KMT2A
SCHEMBL31000753 1.00 MDM4 (0.46) MDM4TP53CASP3PIN1KMT2A
SCHEMBL5913024 1.00 MDM4 (0.46) MDM4TP53CASP3PIN1KMT2A
SCHEMBL8018654 1.00 MDM4 (0.46) MDM4TP53CASP3PIN1KMT2A
SCHEMBL31000751 1.00 MDM4 (0.46) MDM4TP53CASP3PIN1KMT2A
SCHEMBL31000614 0.87 CASP3 (0.43) MDM4TP53CASP3PIN1KMT2A
SCHEMBL31000582 0.87 FFAR1 (0.43) MDM4TP53CASP3PIN1MDM2
SCHEMBL31000535 0.85 HDAC3 (0.43) MDM4TP53CASP3PIN1KMT2A
SCHEMBL31000490 0.85 MDM4 (0.43) MDM4TP53CASP3PIN1MDM2
SCHEMBL6225058 0.84 TACR1 (0.44) PIN1KMT2AMDM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1738798-A Indole derivatives as somatostatin agonists or antagonists TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2006-02-22 CN disclosed
US-20050245571-A1 Amine derivative TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2005-11-03 US disclosed
EP-1437351-A1 AMINE DERIVATIVE Takeda Chemical Industries, Ltd. (JP) 2004-07-14 EP 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-20050245571-A1 Amine derivative NPY1R, SSTR1, SSTR5 MDM4 4828/4885TP53 2783/4885CASP3 1895/4885

“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.