SCHEMBL682189

SCHEMBL682189

CC(C)CC(N)C1(c2ccc(Cl)cc2)CCC1

nearest known ligand 0.97

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.97
ALOX15 P16050 2/20 0.97
TSHR P16473 2/20 0.97
TP53 P04637 1/20 0.97
SLC6A4 P31645 17/20 0.91
SLC6A3 Q01959 17/20 0.91
SLC6A2 P23975 8/20 0.65
CHRM2 P08172 1/20 0.64
ADRA2A P08913 1/20 0.64
ADRA2B P18089 1/20 0.64
ADRA2C P18825 1/20 0.64
HTR2A P28223 1/20 0.64
OPRK1 P41145 1/20 0.64
HTR2B P41595 1/20 0.64
KCNH2 Q12809 1/20 0.64
ALDH1A1 P00352 1/20 0.62
LMNA P02545 1/20 0.62
MAPT P10636 1/20 0.62
MAPK1 P28482 1/20 0.62

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
SCHEMBL2379467 1.00 CYP3A4 (0.97) CYP3A4ALOX15TSHRTP53SLC6A4
SCHEMBL2378403 1.00 CYP3A4 (0.97) CYP3A4ALOX15TSHRTP53SLC6A4
Hydrochloric Acid SCHEMBL2105 0.98 CYP3A4 (1.00) CYP3A4ALOX15TSHRTP53SLC6A4
Water SCHEMBL10423764 0.98 CYP3A4 (0.94) CYP3A4ALOX15TSHRTP53SLC6A4
Hydrochloric Acid SCHEMBL10336934 0.97 CYP3A4 (0.97) CYP3A4ALOX15TSHRTP53SLC6A4
SCHEMBL3517972 0.95 SLC6A4 (1.00) CYP3A4ALOX15TSHRTP53SLC6A4
SCHEMBL15065547 0.93 SLC6A3 (0.85) CYP3A4ALOX15TSHRTP53SLC6A4
SCHEMBL4606333 0.88 CYP3A4 (0.76) CYP3A4ALOX15TSHRTP53SLC6A4
Hydrochloric Acid SCHEMBL6419503 0.86 CYP3A4 (0.78) CYP3A4ALOX15TSHRTP53SLC6A4
SCHEMBL12235320 0.85 CYP3A4 (0.72) CYP3A4ALOX15TSHRTP53SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105636438-A Pharmaceutical composition comprising an AMPK activator and a serotonin active agent and uses thereof CHEN JIANHONG 2016-06-01 CN claimed
EP-2261203-B1 PHENYLCYCLOBUTYLAMIDE DERIVATIVES AND THEIR STEREOISOMERS, THE PREPARING PROCESSES AND THE USES THEREOF BEIJING YINGU CENTURY PHARMACY CO LTD (CN) 2016-05-25 EP claimed
EP-2983473-A2 PHARMACEUTICAL COMPOSITION COMPRISING AN AMPK ACTIVATOR AND A SEROTONERGIC AGENT AND METHODS OF USE THEREOF ALS Mountain Llc (US) 2016-02-17 EP claimed
US-20140350064-A1 PHARMACEUTICAL COMPOSITION COMPRISING AN AMPK ACTIVATOR AND A SEROTONERGIC AGENT AND METHODS OF USE THEREOF ALS MOUNTAIN LLC 2014-11-27 US claimed
WO-2014144130-A2 PHARMACEUTICAL COMPOSITION COMPRISING AN AMPK ACTIVATOR AND A SEROTONERGIC AGENT AND METHODS OF USE THEREOF ALS MOUNTAIN LLC (US) 2014-09-18 WO claimed
US-8497305-B2 Phenylcyclobutylamide derivatives and their stereoisomers, the preparation processes and uses thereof YinGu Pharmaceutical Co., Ltd (CN) 2013-07-30 US claimed
US-20120183600-A1 NOVEL COMPOSITION FOR TREATING METABOLIC SYNDROME AND OTHER CONDITIONS CHEN CHIEN-HUNG (US) 2012-07-19 US claimed
US-20110224305-A1 PHENYLCYCLOBUTYLAMIDE DERIVATIVES AND THEIR STEREOISOMERS, THE PREPARATION PROCESSES AND USES THEREOF BEIJING YINGU CENTURY PHARMACY CO. LTD (CN) 2011-09-15 US claimed
EP-2261203-A1 PHENYLCYCLOBUTYLAMIDE DERIVATIVES AND THEIR STEREOISOMERS, THE PREPARING PROCESSES AND THE USES THEREOF Beijing Cachet Biomedical Co., Ltd (CN) 2010-12-15 EP claimed
CN-101468956-A Schiff base compound and synthesizing method thereof BYD CO LTD (CN) 2009-07-01 CN claimed
WO-2000056318-A1 TREATMENT OF NEUROPATHIC PAIN OR FIBROMYALGIA KNOLL PHARMACEUTICAL COMPANY (US) 2000-09-28 WO claimed
WO-2000056321-A1 TREATMENT OF HYPERACTIVITY DISORDERS KNOLL PHARMACEUTICAL COMPANY (US) 2000-09-28 WO claimed
WO-2000056307-A1 TREATMENT OF HIATIAL HERNIA KNOLL GMBH (DE) 2000-09-28 WO claimed
WO-2000056306-A1 TREATMENT OF OSTEOARTHRITIS KNOLL GMBH (DE) 2000-09-28 WO claimed
WO-2000054765-A1 METHOD OF TREATING EATING DISORDERS KNOLL GMBH (DE) 2000-09-21 WO claimed
US-6046242-A ADMINISTERING TO A PATIENT AN EFFECTIVE AMOUNT OF CHLOROBENZENE SUBSTITUTED CYCLOBUTYLALKYLAMINE COMPOUND TO TREAT URINARY INCONTINENCE BASF AKTIENGESELLSCHAFT (DE) 2000-04-04 US claimed
EP-0828484-A1 USE OF ARYL SUBSTITUTED CYCLOBUTYL ALKYL AMINES FOR THE TREATMENT OF OBESITY Knoll AG (DE) 1998-03-18 EP claimed
WO-1996038134-A1 USE OF ARYL SUBSTITUTED CYCLOBUTYL ALKYL AMINES FOR THE TREATMENT OF OBESITY KNOLL AG (DE) 1996-12-05 WO claimed
WO-1995021615-A1 USE OF ARYLCYCLOBUTYLALKYLAMINES FOR THE TREATMENT OF SEIZURES AND NEUROLOGICAL DISORDERS KNOLL AG (DE) 1995-08-17 WO claimed
EP-0230742-B1 N,N-dimethyl-1-[1-(4-chlorophenyl)cyclobutyl]-3-methylbutylamine hydrochloride monohydrate and pharmaceutical compositions containing it The Boots Company PLC (GB) 1990-09-26 EP 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-20110224305-A1 PHENYLCYCLOBUTYLAMIDE DERIVATIVES AND THEIR STEREOISOMERS, THE PREPARATION PROCESSES AND USES THEREOF AADAC, WIZ, CEBPZ CYP3A4 628/4885ALOX15 1125/4885TSHR 2293/4885

“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.