SCHEMBL6356948

SCHEMBL6356948

CC(=O)O[C@@H]1CCc2ccc(NC(=O)N3CCCC3)cc2[C@H]1NC(=O)c1ccc(Cl)c(Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
KMT2A Q03164 1/20 0.47
CTSS P25774 2/20 0.45
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C19 P33261 1/20 0.44
HTT P42858 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
TMPRSS2 O15393 1/20 0.41
GPR142 Q7Z601 1/20 0.40
MAPT P10636 3/20 0.40
LMNA P02545 2/20 0.40
TP53 P04637 2/20 0.40
CCR2 P41597 3/20 0.40
KCNH2 Q12809 3/20 0.40
CHRNA7 P36544 1/20 0.39
P2RY12 Q9H244 1/20 0.39
OPRM1 P35372 1/20 0.39

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
SCHEMBL7653496 0.86 MEN1 (0.53) MEN1NPC1RAB9AKMT2ACTSS
SCHEMBL6358461 0.81 TAS1R3 (0.42) CTSSCHRNA7OPRM1OPRK1OPRL1
SCHEMBL7546031 0.74 NPC1 (0.60) MEN1NPC1RAB9AKMT2ACYP3A4
SCHEMBL7007596 0.64 RORC (0.46) NPC1RAB9ATMPRSS2
SCHEMBL27979643 0.64 MEN1 (0.84) MEN1NPC1RAB9AKMT2ACYP3A4
SCHEMBL17512426 0.64 RAB9A (0.61) MEN1NPC1RAB9AKMT2ACYP3A4
Hydrochloric Acid SCHEMBL7847628 0.64 RORC (0.45) NPC1RAB9ATMPRSS2
SCHEMBL501922 0.64 NPC1 (0.73) MEN1NPC1RAB9AKMT2ACYP3A4
SCHEMBL25574382 0.63 GPR142 (0.63) MEN1NPC1RAB9AKMT2ACYP3A4
SCHEMBL25574371 0.63 GPR142 (0.58) MEN1NPC1RAB9AKMT2ACYP3A4

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
EP-1003495-A4 PHARMACEUTICAL COMPOUNDS LILLY CO ELI (US) 2002-08-28 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-1003495-A1 PHARMACEUTICAL COMPOUNDS ELI LILLY AND COMPANY (US) 2000-05-31 EP disclosed
WO-1999004778-A1 PHARMACEUTICAL COMPOUNDS ELI LILLY AND COMPANY (US) 1999-02-04 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 MEN1 1772/4885NPC1 896/4885RAB9A 1963/4885

“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.