SCHEMBL1436066

SCHEMBL1436066

CC(=O)c1cccc(OCc2ccccc2Cl)c1

nearest known ligand 0.77

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 3/20 0.77
NPC1 O15118 1/20 0.77
RAB9A P51151 1/20 0.77
MAOB P27338 14/20 0.72
MAOA P21397 5/20 0.72
NR4A1 P22736 1/20 0.58
NR4A3 Q92570 1/20 0.58
GCK P35557 1/20 0.57
LMNA P02545 1/20 0.50
HPGD P15428 1/20 0.50

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
SCHEMBL4638863 0.86 NR4A2 (0.77) NR4A2NPC1RAB9AMAOBMAOA
SCHEMBL1437471 0.85 MAOB (0.68) NR4A2NPC1RAB9AMAOBMAOA
SCHEMBL21483757 0.84 MAOB (0.67) NR4A2NPC1RAB9AMAOBMAOA
SCHEMBL2087954 0.84 MAOB (0.71) NR4A2NPC1RAB9AMAOBMAOA
SCHEMBL2087098 0.84 MAOB (1.00) NR4A2NPC1RAB9AMAOBMAOA
SCHEMBL2087291 0.83 MAOB (0.72) NR4A2NPC1RAB9AMAOBMAOA
SCHEMBL10600243 0.82 RAB9A (0.60) NR4A2NPC1RAB9AMAOBMAOA
SCHEMBL24686734 0.81 NPC1 (0.53) NR4A2NPC1RAB9AMAOBMAOA
SCHEMBL24687054 0.81 NPC1 (0.52) NR4A2NPC1RAB9AMAOBMAOA
SCHEMBL5733382 0.80 NR4A2 (0.64) NR4A2NPC1RAB9AMAOBMAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0933354-B1 CALCIUM RECEPTOR-ACTIVE COMPOUNDS KYOWA HAKKO KIRIN CO LTD (JP) 2011-03-30 EP disclosed
US-7816408-B2 Calcium receptor active compounds NPS PHARMACEUTICALS, INC. (US) 2010-10-19 US disclosed
US-20090176993-A1 Calcium receptor active compounds NPS PHARMACEUTICALS, INC. 2009-07-09 US disclosed
US-6939895-B2 Calcium receptor-active compounds NPS PHARMACEUTICALS, INC. (US) 2005-09-06 US disclosed
US-6750255-B2 SUCH AS (R)-N-(1-(1'-NAPHTHYL)ETHYL)-2-(2',5'-DICHOROPHENYL THIO)ETHYLAMINE; FOR STIMULATION OF SECRETION OF PARATHYROID HORMONE NPS PHARMACEUTICALS, INC. 2004-06-15 US disclosed
US-20030176485-A1 Calcium receptor active compounds NPS PHARMACEUTICALS, INC. 2003-09-18 US disclosed
US-20030144526-A1 Calcium receptor-active compounds NPS PHARMACEUTICALS, INC. 2003-07-31 US disclosed
US-20020107406-A1 Calcium receptor-active compounds NPS PHARMACEUTICALS, INC. (US) 2002-08-08 US disclosed
US-6362231-B1 MODULATOR OF PARATHYROID HORMONE; OSTEOPOROSIS NPS PHARMACEUTICALS, INC. 2002-03-26 US disclosed
EP-0933354-A1 CALCIUM RECEPTOR-ACTIVE COMPOUNDS KIRIN BEER KABUSHIKI KAISHA (JP) 1999-08-04 EP 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 (3 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-20030144526-A1 Calcium receptor-active compounds CASR, CALCR, CNR1 NR4A2 215/4885NPC1 3949/4885RAB9A 951/4885
US-20090176993-A1 Calcium receptor active compounds CASR, CALCR, CACNA1E NR4A2 40/4885NPC1 4529/4885RAB9A 1201/4885
US-20030176485-A1 Calcium receptor active compounds CASR, CNR1, CALCR NR4A2 275/4885NPC1 3730/4885RAB9A 953/4885

“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.