SCHEMBL1850863

SCHEMBL1850863

CC1(C)SCC(C=O)N1C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.46
HTT P42858 1/20 0.32

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
SCHEMBL11193973 0.73 KMT2A (0.58) KMT2AHTT
SCHEMBL22443592 0.71 APLNR (0.32) KMT2A
SCHEMBL19897217 0.68 FFAR3 (0.33)
SCHEMBL14157266 0.68 FFAR3 (0.33)
SCHEMBL1503804 0.67 CYP1A2 (0.31)
SCHEMBL22443509 0.66 TSHR (0.33)
SCHEMBL22443506 0.66 TSHR (0.33)
SCHEMBL19421026 0.64 KMT2A (0.51) KMT2AHTT
SCHEMBL4390806 0.64 KMT2A (0.56) KMT2AHTT
SCHEMBL24668970 0.63 KMT2A (0.35) KMT2A

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
EP-2323996-B1 LUMINOGENIC COMPOUNDS AND METHODS TO DETECT CYTOCHROME P450 3A ENZYMES PROMEGA CORP (US) 2014-10-22 EP disclosed
US-8288559-B2 Luminogenic compounds and methods to detect cytochrome P450 3A enzymes PROMEGA CORPORATION (US) 2012-10-16 US disclosed
EP-2323996-A1 LUMINOGENIC COMPOUNDS AND METHODS TO DETECT CYTOCHROME P450 3A ENZYMES Promega Corporation (US) 2011-05-25 EP disclosed
US-20100062470-A1 LUMINOGENIC COMPOUNDS AND METHODS TO DETECT CYTOCHROME P450 3A ENZYMES PROMEGA CORPORATION (US) 2010-03-11 US disclosed
WO-2010021686-A1 LUMINOGENIC COMPOUNDS AND METHODS TO DETECT CYTOCHROME P450 3A ENZYMES PROMEGA CORPORATION (US) 2010-02-25 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-20100062470-A1 LUMINOGENIC COMPOUNDS AND METHODS TO DETECT CYTOCHROME P450 3A ENZYMES CYP3A43, CYP1A1, CYP3A4 KMT2A 4658/4885HTT 4599/4885

“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.