SCHEMBL16299303

SCHEMBL16299303

CCN(CCCCN)CC(=O)N(CCCCN)CC(=O)N(CCCCN)CC(=O)N(CC(=O)N(CCCCN)CC(=O)N(CC(C)=O)[C@@H](C)c1ccccc1)[C@@H](C)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MC3R P41968 5/20 0.41
MC4R P32245 4/20 0.41
MC1R Q01726 1/20 0.41
SIGMAR1 Q99720 1/20 0.38
CA12 O43570 4/20 0.36
CA1 P00915 4/20 0.36
CA2 P00918 4/20 0.36
CA4 P22748 3/20 0.36
MC5R P33032 4/20 0.36
MAPT P10636 2/20 0.36
CHRM2 P08172 1/20 0.35
CHRM4 P08173 1/20 0.35
CHRM1 P11229 1/20 0.35
CHRM3 P20309 1/20 0.35
OPRM1 P35372 1/20 0.34
LMNA P02545 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34

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
SCHEMBL16299287 0.98 MC3R (0.41) MC3RMC4RMC1RSIGMAR1CA12
SCHEMBL14524599 0.92 MC3R (0.43) MC3RMC4RMC1RCA12CA1
SCHEMBL10085169 0.90 MC3R (0.43) MC3RMC4RMC1RMC5R
SCHEMBL13045405 0.90 MC3R (0.43) MC3RMC4RMC1RMC5ROPRM1
SCHEMBL12387488 0.90 MC3R (0.43) MC3RMC4RMC1RMC5R
SCHEMBL16299312 0.88 MC3R (0.42) MC3RMC4RMC1RMC5R
SCHEMBL12387566 0.88 MC3R (0.43) MC3RMC4RMC1RMC5R
SCHEMBL12387461 0.88 MC3R (0.43) MC3RMC4RMC1RMC5R
SCHEMBL13045382 0.87 MC3R (0.41) MC3RMC4RMC1RSIGMAR1MC5R
SCHEMBL16315947 0.86 MC3R (0.42) MC3RMC4RMC1RMC5R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120027677-A1 Prion-specific peptoid reagents NOVARTIS AG 2012-02-02 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-20120027677-A1 Prion-specific peptoid reagents PRNP, PARL, PCNP MC3R 3280/4885MC4R 3225/4885MC1R 3982/4885

“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.