SCHEMBL4282444

SCHEMBL4282444

CNC(=O)c1noc([C@@H](Cc2ccccc2)N(C)C(=O)[CH]Cc2ccc3ccccc3c2)n1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CAPN1 P07384 4/20 0.39
GHSR Q92847 2/20 0.39
ZAP70 P43403 4/20 0.37
SRC P12931 3/20 0.37
MAOB P27338 1/20 0.36
FCER2 P06734 1/20 0.35
TACR1 P25103 1/20 0.34
PSMB5 P28074 1/20 0.34
MMP9 P14780 1/20 0.33
MMP8 P22894 1/20 0.33
MME P08473 1/20 0.33
CTSL P07711 1/20 0.33
CTSB P07858 1/20 0.33
UTS2R Q9UKP6 1/20 0.33

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
SCHEMBL6601402 1.00 CAPN1 (0.39) CAPN1GHSRZAP70SRCMAOB
SCHEMBL8579396 0.91 SMN1; SMN2 (0.41) CAPN1GHSRZAP70SRCMAOB
SCHEMBL4284133 0.89 MAOB (0.37) CAPN1GHSRZAP70SRCMAOB
SCHEMBL6600950 0.89 CAPN1 (0.37) CAPN1GHSRZAP70SRCMAOB
SCHEMBL6601217 0.85 PSMB5 (0.36) GHSRMAOBFCER2PSMB5MMP9
SCHEMBL6601730 0.85 ZAP70 (0.34) CAPN1GHSRZAP70SRCFCER2
SCHEMBL4282449 0.85 ZAP70 (0.39) CAPN1GHSRZAP70SRCMAOB
SCHEMBL6602122 0.84 MC4R (0.42) GHSRZAP70SRCMAOBFCER2
SCHEMBL6606297 0.82 PSMB5 (0.37) GHSRMAOBTACR1PSMB5MMP9
SCHEMBL6602371 0.81 MC4R (0.40) GHSRZAP70SRCTACR1MMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090149512-A1 Use of Ghrelin Antagonists to the Treatment of Certain CNS Diseases NOVO NORDISK A/S (DK) 2009-06-11 US claimed
US-20090149512-A1 Use of Ghrelin Antagonists to the Treatment of Certain CNS Diseases NOVO NORDISK A/S (DK) 2009-06-11 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-20090149512-A1 Use of Ghrelin Antagonists to the Treatment of Certain CNS Diseases GIPR, GHSR, GPR119 CAPN1 3835/4885GHSR 2/4885ZAP70 3013/4885

“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.