SCHEMBL2310075

SCHEMBL2310075

CC1[C@@H](C(=O)O)[C@H](c2ccc(Cl)cc2)CN1C1=NNCC=C1

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 5/20 0.33
SLC6A3 Q01959 5/20 0.33
SLC6A2 P23975 3/20 0.32
ALDH1A1 P00352 1/20 0.32
GAA P10253 1/20 0.32
MAPK1 P28482 1/20 0.32
L3MBTL1 Q9Y468 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
SCHEMBL2307088 0.76 CYP1A2 (0.46) ALDH1A1GAAMAPK1L3MBTL1
SCHEMBL2304480 0.73 P2RX7 (0.38)
SCHEMBL2307075 0.73 LMNA (0.45)
SCHEMBL2306880 0.72 NOTUM (0.34)
SCHEMBL2310074 0.72 MEN1 (0.42) SLC6A4SLC6A3ALDH1A1
SCHEMBL2307114 0.70 BRD4 (0.42) L3MBTL1
SCHEMBL1920336 0.66 SLC6A4 (0.42) SLC6A4
SCHEMBL348907 0.60 HSD11B1 (0.56)
SCHEMBL3751420 0.59 SLC9A1 (0.60) ALDH1A1GAA
SCHEMBL301295 0.59 SLC9A1 (0.60) ALDH1A1GAA

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 SLC6A4 367/4885SLC6A3 297/4885SLC6A2 248/4885
US-20110245500-A1 MELANOCORTIN RECEPTOR AGONISTS MC1R, MC3R, MC5R SLC6A4 367/4885SLC6A3 297/4885SLC6A2 248/4885
US-20100120783-A1 MELANOCORTIN RECEPTOR AGONISTS MC1R, MC3R, MC5R SLC6A4 367/4885SLC6A3 297/4885SLC6A2 248/4885
US-20110224219-A1 MELANOCORTIN RECEPTOR AGONISTS MC1R, MC3R, MC5R SLC6A4 367/4885SLC6A3 297/4885SLC6A2 248/4885

“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.