SCHEMBL2310074

SCHEMBL2310074

COC(=O)[C@@H]1CN(C2=NNCC=C2)C[C@H]1c1ccc(Cl)cc1

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
KMT2A Q03164 1/20 0.42
SLC6A4 P31645 2/20 0.42
SLC6A3 Q01959 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
SCHEMBL2307088 0.88 CYP1A2 (0.46) MEN1ALDH1A1KMT2A
SCHEMBL2307070 0.76 KMT2A (0.55) MEN1ALDH1A1KMT2A
SCHEMBL2304475 0.76 MEN1 (0.46) MEN1KMT2ASLC6A4SLC6A3
SCHEMBL2306878 0.74 MEN1 (0.42) MEN1ALDH1A1KMT2A
SCHEMBL12992774 0.73 ALDH1A1 (0.64) MEN1ALDH1A1KMT2ASLC6A4SLC6A3
SCHEMBL2306088 0.72 MEN1 (0.43) MEN1ALDH1A1KMT2A
SCHEMBL2310075 0.72 SLC6A4 (0.33) ALDH1A1SLC6A4SLC6A3
SCHEMBL2307110 0.72 SLC6A2 (0.43) SLC6A4SLC6A3
SCHEMBL14920696 0.71 SLC6A2 (0.49) SLC6A4SLC6A3
SCHEMBL3970521 0.68 SLC6A4 (0.55) SLC6A4SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8039622-B2 Melanocortin receptor agonists LG LIFE SCIENCES LTD. (KR) 2011-10-18 US disclosed
US-20110245500-A1 MELANOCORTIN RECEPTOR AGONISTS LG CHEM, LTD. (KR) 2011-10-06 US disclosed
US-20110237795-A1 MELANOCORTIN RECEPTOR AGONISTS LG CHEM, LTD. (KR) 2011-09-29 US disclosed
US-20110224219-A1 MELANOCORTIN RECEPTOR AGONISTS LG LIFE SCIENCES LTD. (KR) 2011-09-15 US disclosed
EP-2350060-A2 MELANOCORTIN RECEPTOR AGONISTS LG Life Sciences Ltd (KR) 2011-08-03 EP disclosed
US-20100120783-A1 MELANOCORTIN RECEPTOR AGONISTS LG LIFE SCIENCE LTD. (KR) 2010-05-13 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 (4 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-20110237795-A1 MELANOCORTIN RECEPTOR AGONISTS MC1R, MC3R, MC5R MEN1 899/4885ALDH1A1 2566/4885KMT2A 1634/4885
US-20110245500-A1 MELANOCORTIN RECEPTOR AGONISTS MC1R, MC3R, MC5R MEN1 899/4885ALDH1A1 2566/4885KMT2A 1634/4885
US-20100120783-A1 MELANOCORTIN RECEPTOR AGONISTS MC1R, MC3R, MC5R MEN1 899/4885ALDH1A1 2566/4885KMT2A 1634/4885
US-20110224219-A1 MELANOCORTIN RECEPTOR AGONISTS MC1R, MC3R, MC5R MEN1 899/4885ALDH1A1 2566/4885KMT2A 1634/4885

“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.