SCHEMBL6358461

SCHEMBL6358461

CC(=O)O[C@@H]1CCc2ccc(N)cc2[C@H]1NC(=O)c1ccc(Cl)c(Cl)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 3/20 0.42
TAS1R1 Q7RTX1 2/20 0.42
TAS1R2 Q8TE23 1/20 0.42
PYGL P06737 2/20 0.40
PYGM P11217 2/20 0.40
CTSS P25774 1/20 0.40
OPRM1 P35372 2/20 0.40
OPRK1 P41145 2/20 0.40
OPRL1 P41146 1/20 0.40
ABCC9 O60706 1/20 0.39
CHRNA7 P36544 2/20 0.39
DHODH Q02127 1/20 0.38
UTS2R Q9UKP6 1/20 0.37
PDE4A P27815 1/20 0.36
PDE4B Q07343 1/20 0.36
PDE4C Q08493 1/20 0.36
PDE4D Q08499 1/20 0.36
POLB P06746 1/20 0.36
TSHR P16473 1/20 0.36
F10 P00742 1/20 0.36

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
SCHEMBL6356948 0.81 MEN1 (0.47) CTSSOPRM1OPRK1OPRL1CHRNA7
SCHEMBL8311914 0.75 KMT2A (0.39) TAS1R3TAS1R1TAS1R2PYGLPYGM
SCHEMBL7101763 0.75 KDM4E (0.48) CTSS
SCHEMBL8307649 0.70 CHRM4 (0.49)
SCHEMBL6363447 0.67 KMT2A (0.43) TAS1R3TAS1R1TAS1R2PYGLPYGM
SCHEMBL6811167 0.66 CHRM4 (0.50)
SCHEMBL8312441 0.65 CHRM4 (0.47)
SCHEMBL5969864 0.64 CA12 (0.56) PDE4APDE4BPDE4CPDE4DTSHR
Hydrochloric Acid SCHEMBL7929443 0.63 CA12 (0.54) TSHR
SCHEMBL27517416 0.63 HPGD (0.54) TAS1R3TAS1R2POLBTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0874625-B1 INDANE DERIVATIVES FOR ANTIPSYCHOTIC COMPOSITIONS LILLY CO ELI (US) 2005-03-16 EP disclosed
US-6429317-B1 MUSCARINIC RECEPTOR MODULATORS; CENTRAL NERVOUS SYSTEM AND PSYCHOLOGICAL DISORDERS; SCHIZOPHRENIA ELI LILLY AND COMPANY 2002-08-06 US disclosed
US-6395735-B2 AN INDANE-LIKE COMPOUNDS WHICH CAN BE USEFUL FOR TREATING PSYCHOSIS AND OTHER CONDITIONS ASSOCIATED WITH MODULATION OF A MUSCARINIC RECEPTOR ELI LILLY AND COMPANY 2002-05-28 US disclosed
US-20010012848-A1 Pharmaceutical compounds HOLLINSHEAD SEAN PATRICK (US) 2001-08-09 US disclosed
US-6211364-B1 PSYCHOLOGICAL DISORDERS; ALZHEIMER'S DISEASE; CROHN'S DISEASE; PARKINSON DISEASES ELI LILLY AND COMPANY 2001-04-03 US disclosed
EP-0971885-A4 PROCESS FOR PREPARING INDANE-LIKE COMPOUNDS LILLY CO ELI (US) 2001-03-07 EP disclosed
EP-0971885-A1 PROCESS FOR PREPARING INDANE-LIKE COMPOUNDS ELI LILLY AND COMPANY (US) 2000-01-19 EP disclosed
WO-1998031660-A1 PROCESS FOR PREPARING INDANE-LIKE COMPOUNDS ELI LILLY AND COMPANY (US) 1998-07-23 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-20010012848-A1 Pharmaceutical compounds CHRM5, CHRM4, CHRM3 TAS1R3 567/4885TAS1R1 539/4885TAS1R2 501/4885

“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.