SCHEMBL6206243

SCHEMBL6206243

C[C@@H](c1ccc2ccccc2c1)N1CCC(=O)CC1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.57
MCHR1 Q99705 2/20 0.49
UGT2B7 P16662 1/20 0.47
CYP2D6 P10635 1/20 0.46
DRD4 P21917 1/20 0.45
MAPT P10636 1/20 0.44
OGA O60502 3/20 0.44
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
GAA P10253 1/20 0.41
MC4R P32245 1/20 0.41
MMP9 P14780 1/20 0.40

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
SCHEMBL6306254 1.00 HSD11B1 (0.57) HSD11B1MCHR1UGT2B7CYP2D6DRD4
SCHEMBL31046817 0.85 UGT2B7 (0.52) HSD11B1MCHR1UGT2B7CYP2D6DRD4
SCHEMBL8983490 0.85 UGT2B7 (0.52) HSD11B1MCHR1UGT2B7CYP2D6DRD4
SCHEMBL8099850 0.81 CYP2D6 (0.70) HSD11B1CYP2D6KDM4EALDH1A1MC4R
SCHEMBL1586528 0.81 CYP2D6 (0.70) HSD11B1CYP2D6KDM4EALDH1A1MC4R
SCHEMBL19613500 0.81 CYP2D6 (0.70) HSD11B1CYP2D6KDM4EALDH1A1MC4R
SCHEMBL4601165 0.81 CYP2D6 (0.70) HSD11B1CYP2D6KDM4EALDH1A1MC4R
SCHEMBL6313012 0.78 MCHR1 (0.53) HSD11B1MCHR1UGT2B7CYP2D6DRD4
SCHEMBL6208247 0.78 MCHR1 (0.53) HSD11B1MCHR1UGT2B7CYP2D6DRD4
SCHEMBL6187443 0.78 MCHR1 (0.53) HSD11B1MCHR1UGT2B7CYP2D6DRD4

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
US-6921821-B2 Antagonists of melanin concentrating hormone receptor ABBOTT LABORATORIES (US) 2005-07-26 US disclosed
EP-1534703-A2 ANTAGONISTS OF MELANIN CONCENTRATING HORMONE RECEPTOR ABBOTT LABORATORIES (US) 2005-06-01 EP disclosed
US-20040106645-A1 Antagonists of melanin concentrating hormone receptor MILLENNIUM PHARMACEUTICALS, INC. 2004-06-03 US disclosed
WO-2003106452-A2 ANTAGONISTS OF MELANIN CONCENTRATING HORMONE RECEPTOR MILLENNIUM PHARMACEUTICALS, INC. (US) 2003-12-24 WO 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-20040106645-A1 Antagonists of melanin concentrating hormone receptor MCHR1, MCHR2, MC1R HSD11B1 235/4885MCHR1 1/4885UGT2B7 425/4885

“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.