SCHEMBL6111144

SCHEMBL6111144

O=C(O)C1(Cl)CCCO1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL27350595 0.93 CYP2C19 (0.31)
SCHEMBL6147874 0.81
SCHEMBL27925257 0.74
SCHEMBL174397 0.70 FFAR3 (0.32)
SCHEMBL2772996 0.70 FFAR3 (0.32)
SCHEMBL15571664 0.68
Hydrochloric Acid SCHEMBL2198959 0.68 FFAR3 (0.31)
Hydrochloric Acid SCHEMBL4359360 0.68 FFAR3 (0.31)
SCHEMBL28113416 0.67 FFAR3 (0.31)
SCHEMBL28327359 0.67

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-0310732-B1 PROCESS FOR THE PREPARATION OF N-ACYL-N-ALKYL-2,6-DIALKYL-3-CHLOROANILINES CIBA-GEIGY AG (CH) 1992-03-11 EP claimed
US-4721797-A Process for the preparation of N-acyl-N-alkyl-2,6-dialkyl-3-chloroanilines CIBA-GEIGY CORPORATION (US) 1988-01-26 US claimed
CN-115109048-B (hetero) aryl amide compound 中国药科大学 2023-12-08 CN disclosed
WO-2006090268-A2 PROCESSES FOR THE PREPARATION OF ALFUZOSIN AND SALTS THEREOF AND NOVEL CRYSTALLINE FORMS OF ALFUZOSIN GLENMARK PHARMACEUTICALS LIMITED (US) 2006-08-31 WO disclosed
US-5959108-A SUSPENDING AND HEAT TREATING A CRYSTALLINE ADDUCT OF TERAZOSINE HYDROCHLORIDE AND METHANOL IN A POLAR SOLVENT OF A LOW-MOLECULAR-WEIGHT ALCOHOL OR KETONE; SEPARATING THE CRYSTAL FORM IV; REDUCED HYGROSCOPICITY AND SOLVENT RETENTION CU CHEMIE UETIKON GMBH (DE) 1999-09-28 US disclosed
US-4772309-A 5-acylamino-pyrazoles, composition containing them, and herbicidal and plant growth regulating method of using them BAYER AKTIENGESELLSCHAFT (DE) 1988-09-20 US disclosed
US-4721797-A Process for the preparation of N-acyl-N-alkyl-2,6-dialkyl-3-chloroanilines CIBA-GEIGY CORPORATION (US) 1988-01-26 US disclosed
US-4199588-A TRANQUILIZERS, MUSCLE RELAXANTS, ANTICONVULSANTS BOEHRINGER INGELHEIM GMBH (DE) 1980-04-22 US disclosed
US-4100288-A N-Tetrahydrofurfuryl-noroxymorphones, their salts, and analgesic compositions and methods employing them BOEHRINGER INGELHEIM GMBH (DE) 1978-07-11 US disclosed
US-4087532-A Analgesically useful 2-tetrahydrofurfuryl-5-lower alkyl-2-oxy-6,7-benzomorphans and salts thereof BOEHRINGER INGELHEIM GMBH (DT) 1978-05-02 US disclosed