SCHEMBL838201

SCHEMBL838201

N#CC1(c2ccc(Cl)cc2Cl)CC1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 4/20 0.45
SLC6A3 Q01959 4/20 0.45
OPRM1 P35372 2/20 0.40
TP53 P04637 1/20 0.38
SLC6A2 P23975 1/20 0.37
ALDH1A1 P00352 1/20 0.36
GABRA1 P14867 4/20 0.36
GABRG2 P18507 4/20 0.36
GABRB3 P28472 4/20 0.36
GABRB1 P18505 2/20 0.36
GABRB2 P47870 2/20 0.36
HSD11B1 P28845 1/20 0.35
HSD11B2 P80365 1/20 0.35
TSHR P16473 2/20 0.34
HSD17B10 Q99714 1/20 0.34
CYP3A4 P08684 1/20 0.34

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
SCHEMBL29457607 1.00 SLC6A4 (0.45) SLC6A4SLC6A3OPRM1TP53SLC6A2
SCHEMBL11468178 0.93 SLC6A4 (0.50) SLC6A4SLC6A3OPRM1TP53SLC6A2
SCHEMBL18742609 0.93 SLC6A4 (0.46) SLC6A4SLC6A3OPRM1TP53SLC6A2
SCHEMBL8184370 0.91 SLC6A4 (0.53) SLC6A4SLC6A3OPRM1SLC6A2ALDH1A1
SCHEMBL6962020 0.88 HTR2C (0.40) SLC6A4SLC6A3OPRM1SLC6A2ALDH1A1
SCHEMBL28678474 0.88 SLC6A4 (0.40) SLC6A4SLC6A3OPRM1SLC6A2ALDH1A1
SCHEMBL11093050 0.87 SLC6A3 (0.39) SLC6A4SLC6A3OPRM1SLC6A2ALDH1A1
SCHEMBL28691096 0.83 OPRM1 (0.39) SLC6A4SLC6A3OPRM1
SCHEMBL31454423 0.81 OPRM1 (0.38) SLC6A4SLC6A3OPRM1
SCHEMBL31459802 0.81 HDAC6 (0.36) SLC6A4SLC6A3OPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118239861-A Preparation method of 1- (2, 4-dichlorophenyl) -1-cyclopropanecarbonitrile 山东京博农化科技股份有限公司 2024-06-25 CN claimed
US-4859232-A Substituted-aryl cyclopropanecarbonitriles and derivatives thereof as herbicide antidotes MONSANTO COMPANY (US) 1989-08-22 US claimed
EP-3710422-B1 PROCESS FOR THE PREPARATION OF ENANTIOMERICALLY AND DIASTEREOMERICALLY ENRICHED CYCLOBUTANE AMINES AND AMIDES SYNGENTA CROP PROTECTION AG (CH) 2026-01-07 EP disclosed
CN-118239861-A Preparation method of 1- (2, 4-dichlorophenyl) -1-cyclopropanecarbonitrile 山东京博农化科技股份有限公司 2024-06-25 CN disclosed
CN-118239861-A Preparation method of 1- (2, 4-dichlorophenyl) -1-cyclopropanecarbonitrile 山东京博农化科技股份有限公司 2024-06-25 CN disclosed
CN-118239861-A Preparation method of 1- (2, 4-dichlorophenyl) -1-cyclopropanecarbonitrile 山东京博农化科技股份有限公司 2024-06-25 CN disclosed
CN-114163382-B Cyclobutanamide compound or salts and composition acceptable by pesticides and application thereof 海利尔药业集团股份有限公司 2024-02-27 CN disclosed
CN-111417618-B Process for preparing enantiomerically and diastereomerically enriched cyclobutane amines and amides 先正达参股股份有限公司 2023-06-30 CN disclosed
CN-114163382-A Cyclobutanamide compound or salt thereof acceptable as pesticide, composition and application thereof 海利尔药业集团股份有限公司 2022-03-11 CN disclosed
US-11053188-B2 Process for the preparation of enantiomerically and diastereomerically enriched cyclobutane amines and amides SYNGENTA PARTICIPATIONS AG (CH) 2021-07-06 US disclosed
US-20200407311-A1 PROCESS FOR THE PREPARATION OF ENANTIOMERICALLY AND DIASTEREOMERICALLY ENRICHED CYCLOBUTANE AMINES AND AMIDES SYNGENTA PARTICIPATIONS AG (CH) 2020-12-31 US disclosed
EP-1960376-A1 OXADIAZOLE DERIVATIVES WITH CRTH2 RECEPTOR ACTIVITY 7TM Pharma A/S (DK) 2008-08-27 EP disclosed
WO-2008061781-A1 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURO-DEGENERATIVE DISEASES NV REMYND (BE) 2008-05-29 WO disclosed
US-7297708-B2 Heteroaromatic substituted cyclopropane as corticotropin releasing hormone ligands BRISTOL-MYERS SQUIBB COMPANY (US) 2007-11-20 US disclosed
US-7276526-B2 Substituted thiazoles and oxazoles as corticotropin releasing hormone ligands BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2007-10-02 US disclosed
WO-2007090617-A2 THIADIAZOLE DERIVATIVES FOR THE TREATMENT OF NEURO DEGENERATIVE DISEASES NV REMYND (BE) 2007-08-16 WO disclosed
WO-2007062773-A1 OXADIAZOLE DERIVATIVES WITH CRTH2 RECEPTOR ACTIVITY 7TM PHARMA A/S (DK) 2007-06-07 WO disclosed
US-20030229091-A1 Heteroaromatic substituted cyclopropane as corticotropin releasing hormone ligands BRISTOL-MYERS SQUIBB COMPANY 2003-12-11 US disclosed
US-20030114502-A1 Substituted thiazoles and oxazoles as corticotropin releasing hormone ligands BRISTOL-MYERS SQUIBB PHARMA COMPANY 2003-06-19 US disclosed
US-4859232-A Substituted-aryl cyclopropanecarbonitriles and derivatives thereof as herbicide antidotes MONSANTO COMPANY (US) 1989-08-22 US 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 (4 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-20030229091-A1 Heteroaromatic substituted cyclopropane as corticotropin releasing hormone ligands CRHR1, CRH, CRHR2 SLC6A4 404/4885SLC6A3 545/4885OPRM1 64/4885
US-20030114502-A1 Substituted thiazoles and oxazoles as corticotropin releasing hormone ligands CRH, CRHR1, CRHR2 SLC6A4 349/4885SLC6A3 450/4885OPRM1 126/4885
US-20200407311-A1 PROCESS FOR THE PREPARATION OF ENANTIOMERICALLY AND DIASTEREOMERICALLY ENRICHED CYCLOBUTANE AMINES AND AMIDES TBCB, ADORA2B, ADRA2B SLC6A4 4213/4885SLC6A3 4715/4885OPRM1 2129/4885
US-11053188-B2 Process for the preparation of enantiomerically and diastereomerically enriched cyclobutane amines and amides TBCB, ADORA2B, CCNB3 SLC6A4 4283/4885SLC6A3 4636/4885OPRM1 2131/4885

“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.