SCHEMBL1978538

SCHEMBL1978538

CCCNc1cc[c]cc1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.41
GAA P10253 4/20 0.39
ALDH1A1 P00352 3/20 0.37
TNIK Q9UKE5 1/20 0.33
IDO1 P14902 1/20 0.33
EDNRA P25101 1/20 0.33
HTT P42858 1/20 0.33
LIMK1 P53667 1/20 0.33
KDM4E B2RXH2 1/20 0.33
HPGD P15428 1/20 0.33
HSD17B10 Q99714 1/20 0.33
NR1I2 O75469 1/20 0.33
AHR P35869 1/20 0.33
THRB P10828 1/20 0.32
AR P10275 2/20 0.32

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
SCHEMBL694336 0.86 MAPT (0.43) MAPTGAAALDH1A1KDM4E
SCHEMBL1414747 0.85 ABL1 (0.45) MAPTALDH1A1
SCHEMBL7864090 0.83 ABL1 (0.47) MAPTALDH1A1HTT
SCHEMBL2874812 0.83 ABL1 (0.47) MAPTALDH1A1HTT
SCHEMBL7863952 0.83 ABL1 (0.47) MAPTALDH1A1HTT
SCHEMBL5543069 0.83 ABL1 (0.47) MAPTALDH1A1HTT
SCHEMBL10769826 0.83 ABL1 (0.47) MAPTALDH1A1HTT
SCHEMBL2059888 0.83 ABL1 (0.47) MAPTALDH1A1HTT
SCHEMBL222543 0.83 ABL1 (0.47) MAPTALDH1A1HTT
SCHEMBL220260 0.83 ABL1 (0.47) MAPTALDH1A1HTT

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 148 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101591530-B Fluorescent probe for detecting glutathione reductase and bioactive sulfhydryl compound, and synthetic method and application thereof CHINESE ACAD TECH INST PHYSICS 2013-01-23 CN claimed
CN-101525497-B pyrazoline pyridino-benzo coumarin fluorescent dye derivative and synthesis method and application thereof CHINESE ACAD TECH INST PHYSICS 2012-07-04 CN claimed
CN-101368003-B pyrazoline pyridino-coumarin fluorescent dye derivative and synthesis method and application thereof CHINESE ACAD TECH INST PHYSICS 2011-09-14 CN claimed
US-20110166132-A1 Gamma Secretase Modulators AMGEN INC. (US) 2011-07-07 US claimed
EP-2231602-A1 GAMMA SECRETASE MODULATORS Amgen, Inc (US) 2010-09-29 EP claimed
CN-101591530-A Fluorescent probe for detecting glutathione reductase and bioactive sulfhydryl compound, and synthetic method and application thereof CHINESE ACAD TECH INST PHYSICS (CN) 2009-12-02 CN claimed
CN-101525497-A Pyrazoline pyridino-benzo coumarin fluorescent dye derivative and synthesis method and application thereof CHINESE ACAD TECH INST PHYSICS (CN) 2009-09-09 CN claimed
EP-1781617-A4 ALPHA, BETA-UNSATURATED ESTERS AND ACIDS BY STEREOSELECTIVE DEHYDRATION JANSSEN PHARMACEUTICA NV (BE) 2009-06-24 EP claimed
WO-2009075874-A1 GAMMA SECRETASE MODULATORS AMGEN INC. (US) 2009-06-18 WO claimed
CN-101368003-A Pyrazoline pyridino-coumarin fluorescent dye derivative and synthesis method and application thereof CHINESE ACAD TECH INST PHYSICS (CN) 2009-02-18 CN claimed
WO-2004007463-A1 CCK-1 RECEPTOR MODULATORS JANSSEN PHARMACEUTICA, N.V. (BE) 2004-01-22 WO claimed
EP-1076649-A1 ISOQUINOLINE COMPOUND MELANOCORTIN RECEPTOR LIGANDS AND METHODS OF USING SAME TREGA BIOSCIENCES, INC. (US) 2001-02-21 EP claimed
US-6127381-A A MELANOCORTIN RECEPTOR LIGAND FOR REGULATING FOOD INTAKE AND BODY WEIGHT, REGULATING CYTOKINE ACTIVITY, ANTI-INFLAMMATORY ACTIVITY LION BIOSCIENCE AG (DE) 2000-10-03 US claimed
EP-0830349-B1 METHOD FOR PREPARING N, N'-DISUBSTITUED CYCLIC UREAS DU PONT PHARM CO (US) 2000-03-22 EP claimed
WO-1999055679-A1 ISOQUINOLINE COMPOUND MELANOCORTIN RECEPTOR LIGANDS AND METHODS OF USING SAME TREGA BIOSCIENCES, INC. (US) 1999-11-04 WO claimed
EP-0830349-A1 METHOD FOR PREPARING N, N'-DISUBSTITUED CYCLIC UREAS THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1998-03-25 EP claimed
WO-1996039393-A1 METHOD FOR PREPARING N, N'-DISUBSTITUED CYCLIC UREAS THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1996-12-12 WO claimed
US-5134150-A Administering diaryl-substituted imidazothiazoles; antiarthritic agents SMITHKLINE BEECHAM CORPORATION (US) 1992-07-28 US claimed
EP-0032856-B1 2,3-DIHYDROIMIDAZO (1,2-B) PYRIDAZINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR THERAPEUTICAL USE SYNTHELABO (FR) 1983-02-09 EP claimed
US-4353903-A 2,3-Dihydro-imidazo[1,2-b]pyridazine derivatives, their preparation and use in treatment of depression SYNTHELABO (FR) 1982-10-12 US claimed

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-20110166132-A1 Gamma Secretase Modulators BACE1, BACE2, PSEN1 MAPT 173/4885GAA 11/4885ALDH1A1 3262/4885

“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.