SCHEMBL13108944

SCHEMBL13108944

CSCCC(NC(=O)OCC1c2ccccc2-c2ccccc21)C(C)=O

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ FDFT1 P37268 2/20 0.49
▸ MDM4 O15151 2/20 0.48
▸ TP53 P04637 2/20 0.48
▸ CASP3 P42574 2/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ HDAC1 Q13547 1/20 0.47
▸ HDAC2 Q92769 1/20 0.47
▸ MDM2 Q00987 1/20 0.45
▸ EPHX2 P34913 1/20 0.45

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
SCHEMBL13029965 1.00 FDFT1 (0.49) FDFT1MDM4TP53CASP3KMT2A
SCHEMBL29362132 0.91 FDFT1 (0.57) FDFT1MDM4TP53CASP3MDM2
SCHEMBL29087900 0.91 FDFT1 (0.49) FDFT1MDM4TP53CASP3KMT2A
SCHEMBL29762010 0.91 FDFT1 (0.57) FDFT1MDM4TP53CASP3MDM2
SCHEMBL800305 0.91 FDFT1 (0.57) FDFT1MDM4TP53CASP3MDM2
SCHEMBL23056266 0.91 FDFT1 (0.49) FDFT1MDM4TP53CASP3HDAC1
SCHEMBL800035 0.91 FDFT1 (0.57) FDFT1MDM4TP53CASP3MDM2
SCHEMBL4600701 0.91 FDFT1 (0.57) FDFT1MDM4TP53CASP3MDM2
SCHEMBL29400804 0.91 FDFT1 (0.57) FDFT1MDM4TP53CASP3MDM2
SCHEMBL29768618 0.91 FDFT1 (0.57) FDFT1MDM4TP53CASP3MDM2

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
US-7816489-B2 Methods for making intermediates and oxytocin analogues FERRING B.V. (NL) 2010-10-19 — — US disclosed
US-20080177035-A1 METHODS FOR MAKING INTERMEDIATES AND OXYTOCIN ANALOGUES FERRING B.V. (NL) 2008-07-24 — — US disclosed
US-7304181-B2 Methods for making intermediates and oxytocin analogues FERRING BV (NL) 2007-12-04 — — 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-20080177035-A1 METHODS FOR MAKING INTERMEDIATES AND OXYTOCIN ANALOGUES OXTR, AVPR1A, AVPR1B FDFT1 2321/4885MDM4 4391/4885TP53 4366/4885

“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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