SCHEMBL1491004

SCHEMBL1491004

Fc1[c]ccc(-c2ccc(Br)cc2)c1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.39
MAPK1 P28482 1/20 0.39
CYP2A6 P11509 1/20 0.33
CA12 O43570 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
TDP2 O95551 1/20 0.32
DHODH Q02127 1/20 0.31
CYP11B1 P15538 3/20 0.31
CYP11B2 P19099 2/20 0.31
ALAD P13716 1/20 0.31
MEN1 O00255 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.31
CYP17A1 P05093 1/20 0.30
CYP21A2 P08686 1/20 0.30

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
SCHEMBL7861005 0.84
SCHEMBL533230 0.83 BCL2L1 (0.35) CA12CA9CYP11B1CYP11B2MAPT
SCHEMBL27338776 0.81 ALOX5 (0.40) ALDH1A1MAPK1MEN1GAAMAPT
SCHEMBL546983 0.80
SCHEMBL6017910 0.79 MCL1 (0.39) CA12CA9MAPT
SCHEMBL433164 0.79 ALOX5 (0.42) ALDH1A1CYP2A6TDP2MEN1MAPT
SCHEMBL27906589 0.78 ALDH1A1 (0.42) ALDH1A1MAPK1CYP2A6CA12CA2
SCHEMBL694723 0.78 ALDH1A1 (0.41) ALDH1A1CYP2A6MEN1GAAMAPT
SCHEMBL144207 0.76 KIF11 (0.47) CA12CA9TDP2
SCHEMBL17514911 0.76 ESR1 (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8946261-B2 Substituted 1, 2, 3, 4-tetrahydroquinolin-7-yl carbamates as acetylcholinesterase inhibitors for treatment of Alzheimer's disease COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2015-02-03 US disclosed
EP-2675790-A1 SUBSTITUTED 1, 2, 3, 4-TETRAHYDROQUINOLIN-7-YL CARBAMATES AS ACETYLCHOLINESTERASE INHIBITORS FOR TREATMENT OF ALZHEIMER'S DISEASE Council of Scientific & Industrial Research (IN) 2013-12-25 EP disclosed
US-20130324573-A1 SUBSTITUTED 1, 2, 3, 4-TETRAHYDROQUINOLIN-7-YL CARBAMATES AS ACETYLCHOLINESTERASE INHIBITORS FOR TREATMENT OF ALZHEIMER'S DISEASE COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2013-12-05 US disclosed
WO-2012111021-A1 SUBSTITUTED 1, 2, 3, 4-TETRAHYDROQUINOLIN-7-YL CARBAMATES AS ACETYLCHOLINESTERASE INHIBITORS FOR TREATMENT OF ALZHEIMER'S DISEASE COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (AN INDIAN REGISTERED BODY INCORPORATED UNDER THE REGISTRATION OF SOCIETIES ACT (ACT XXI OF 1860) (IN) 2012-08-23 WO disclosed
EP-2477982-A2 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM Calcimedica, Inc. (US) 2012-07-25 EP disclosed
WO-2011034962-A2 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA INC. (US) 2011-03-24 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-20130324573-A1 SUBSTITUTED 1, 2, 3, 4-TETRAHYDROQUINOLIN-7-YL CARBAMATES AS ACETYLCHOLINESTERASE INHIBITORS FOR TREATMENT OF ALZHEIMER'S DISEASE ACHE, BCHE, CHAT ALDH1A1 1202/4885MAPK1 1625/4885CYP2A6 182/4885

“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.