SCHEMBL14959515

SCHEMBL14959515

C[C@@H]1CC12CC(CO)N(Cc1ccccc1)C2

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.42
MAPT P10636 1/20 0.42
GRM6 O15303 1/20 0.41
GBA1 P04062 1/20 0.40
OPRM1 P35372 2/20 0.40
OPRD1 P41143 1/20 0.40
OPRK1 P41145 1/20 0.40
DRD2 P14416 4/20 0.39
DRD3 P35462 4/20 0.39
SPHK2 Q9NRA0 2/20 0.38
SPHK1 Q9NYA1 2/20 0.38

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
SCHEMBL8225577 0.85 SIGMAR1 (0.40) SIGMAR1MAPTGRM6GBA1OPRM1
SCHEMBL8142711 0.82 GBA1 (0.46) SIGMAR1MAPTGRM6GBA1SPHK2
SCHEMBL12187945 0.79 SIGMAR1 (0.42) SIGMAR1MAPTGRM6GBA1DRD2
SCHEMBL14885473 0.79 GRM6 (0.43) SIGMAR1MAPTGRM6GBA1OPRK1
SCHEMBL8224955 0.79 GRM6 (0.43) SIGMAR1MAPTGRM6GBA1OPRK1
SCHEMBL2805318 0.78 SIGMAR1 (0.41) SIGMAR1MAPTGRM6GBA1SPHK2
SCHEMBL4563595 0.78 SIGMAR1 (0.41) SIGMAR1MAPTGRM6GBA1SPHK2
SCHEMBL12163773 0.78 SIGMAR1 (0.41) SIGMAR1MAPTGRM6GBA1SPHK2
SCHEMBL16716374 0.78 SIGMAR1 (0.41) SIGMAR1MAPTGRM6GBA1SPHK2
SCHEMBL8159118 0.77 SIGMAR1 (0.41) SIGMAR1MAPTGRM6GBA1OPRM1

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-20130149281-A1 ORGANIC COMPOUNDS AND THEIR USES NOVARTIS AG (CH) 2013-06-13 US disclosed
US-8445527-B2 Organic compounds and their uses NOVARTIS AG (CH) 2013-05-21 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-20130149281-A1 ORGANIC COMPOUNDS AND THEIR USES OAT, HAVCR2, CPT1A SIGMAR1 258/4885MAPT 1378/4885GRM6 1225/4885

“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.