SCHEMBL6469894

SCHEMBL6469894

CC(=O)N[C@H](Cc1ccc2ccccc2c1)C(N)=O

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 1/20 0.62
FCER2 P06734 5/20 0.59
MMP9 P14780 4/20 0.53
MMP8 P22894 2/20 0.53
MC5R P33032 2/20 0.53
MC1R Q01726 2/20 0.53
MME P08473 2/20 0.51
ACE P12821 2/20 0.51
CPA1 P15085 2/20 0.51
ACE2 Q9BYF1 2/20 0.51
ACACB O00763 1/20 0.51
HTR2A P28223 1/20 0.50
HTR2C P28335 1/20 0.50
HTR2B P41595 1/20 0.50
IDE P14735 3/20 0.49
MMP3 P08254 1/20 0.49
CA2 P00918 1/20 0.49
OPRD1 P41143 1/20 0.47

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
SCHEMBL607214 0.87 MME (0.65) TACR1MMP9MMP8MMEACE
SCHEMBL8712438 0.87 MME (0.65) TACR1MMP9MMP8MMEACE
SCHEMBL607215 0.87 MME (0.65) TACR1MMP9MMP8MMEACE
SCHEMBL29386502 0.87 MME (0.65) TACR1MMP9MMP8MMEACE
SCHEMBL30995920 0.86 FCER2 (0.63) TACR1FCER2MMP9MMP8MC5R
SCHEMBL22788735 0.86 TACR1 (0.62) TACR1FCER2MMP9MMP8MME
SCHEMBL16348725 0.85 FCER2 (0.55) TACR1FCER2MMP9MMP8MC5R
SCHEMBL31618325 0.85 FCER2 (0.55) TACR1FCER2MMP9MMP8MC5R
SCHEMBL8712763 0.84 TACR1 (0.72) TACR1MMP9MMP8MMEACE
SCHEMBL6664566 0.84 TACR1 (0.72) TACR1MMP9MMP8MMEACE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3357513-B1 PHARMACEUTICAL COMPOSITION AND APPLICATION THEREOF KANGPU BIOPHARMACEUTICALS LTD (CN) 2023-10-25 EP disclosed
EP-3527210-B1 COMBINED COMPOSITION COMPRISING A BENZOHETEROCYCLIC COMPOUND AND AN ANDROGEN RECEPTOR PATHWAY MODULATOR AND USES THEREOF KANGPU BIOPHARMACEUTICALS LTD (CN) 2021-06-09 EP disclosed
EP-3357513-A1 PHARMACEUTICAL COMPOSITION AND APPLICATION THEREOF Kangpu Biopharmaceuticals, Ltd. (CN) 2018-08-08 EP disclosed
US-20050058725-A1 Combination therapy including a matrix metalloproteinase inhibitor and an antineoplastic agent MCKEARN JOHN P (US) 2005-03-17 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-20050058725-A1 Combination therapy including a matrix metalloproteinase inhibitor and an antineoplastic agent MMP3, MMP10, MMP25 TACR1 3104/4885FCER2 3499/4885MMP9 13/4885

“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.