SCHEMBL7218504

SCHEMBL7218504

CN(C(=O)c1ccc(Cl)c(Cl)c1)[C@@H]1CCCC[C@@H]1N1CCCC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 9/20 1.00
▸ CYP3A4 P08684 4/20 1.00
▸ CYP2D6 P10635 4/20 1.00
▸ TSHR P16473 3/20 1.00
▸ CYP1A2 P05177 2/20 1.00
▸ CYP2C19 P33261 2/20 1.00
▸ OPRK1 P41145 5/20 0.66
▸ OPRM1 P35372 2/20 0.66
▸ TP53 P04637 2/20 0.66
▸ ALDH1A1 P00352 2/20 0.66
▸ MEN1 O00255 1/20 0.66
▸ MTOR P42345 1/20 0.66
▸ RAB9A P51151 1/20 0.66
▸ KMT2A Q03164 1/20 0.66
▸ OPRD1 P41143 1/20 0.66
▸ MAPK8 P45983 1/20 0.66
▸ MAPK9 P45984 1/20 0.66
▸ MAPK10 P53779 1/20 0.66
▸ PMP22 Q01453 3/20 0.65
▸ SMN1; SMN2 Q16637 1/20 0.65

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
SCHEMBL7218502 1.00 SIGMAR1 (1.00) SIGMAR1CYP3A4CYP2D6TSHRCYP1A2
SCHEMBL11610023 1.00 SIGMAR1 (1.00) SIGMAR1CYP3A4CYP2D6TSHRCYP1A2
SCHEMBL29766818 1.00 SIGMAR1 (1.00) SIGMAR1CYP3A4CYP2D6TSHRCYP1A2
Hydrochloric Acid SCHEMBL10340142 0.99 SIGMAR1 (0.98) SIGMAR1CYP3A4CYP2D6TSHRCYP1A2
Hydrochloric Acid SCHEMBL10340144 0.99 SIGMAR1 (0.98) SIGMAR1CYP3A4CYP2D6TSHRCYP1A2
Hydrochloric Acid SCHEMBL14809487 0.98 SIGMAR1 (0.95) SIGMAR1CYP3A4CYP2D6TSHRCYP1A2
SCHEMBL10340106 0.97 SIGMAR1 (0.95) SIGMAR1CYP3A4CYP2D6TSHRCYP1A2
SCHEMBL10340107 0.97 SIGMAR1 (0.95) SIGMAR1CYP3A4CYP2D6TSHRCYP1A2
SCHEMBL11248186 0.90 SIGMAR1 (0.81) SIGMAR1CYP3A4CYP2D6TSHRCYP1A2
SCHEMBL11457164 0.87 SIGMAR1 (0.77) SIGMAR1CYP3A4CYP2D6TSHRCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0248824-B1 USE OF CIS-N-(2 AMINOCYCLOALIPHATIC) BENZENE ACETAMIDE AND BENZAMIDE FOR THE MANUFACTURE OF ANTICONVULSANTS THE UPJOHN COMPANY (US) 1990-01-17 — — EP claimed
US-4801604-A REDUCED ANALGESIC PROPERTIES THE UPJOHN COMPANY (US) 1989-01-31 — — US claimed
EP-0248824-A1 Use of CIS-N-(2 Aminocycloaliphatic) benzene acetamide and Benzamide for the manufacture of anticonvulsants. UPJOHN CO (US) 1987-12-16 — — EP claimed
EP-0222533-A1 Cis-N-[(2-aminocycloaliphatic)benzene acetamide and -benzamide anticonvulsants THE UPJOHN COMPANY (US) 1987-05-20 — — EP claimed
WO-1987002584-A1 CIS-N-(2-AMINOCYCLOALIPHATIC)BENZENE ACETAMIDE AND -BENZAMIDE ANTICONVULSANTS THE UPJOHN COMPANY (US) 1987-05-07 — — WO claimed
US-6656930-B2 Treatment of central nervous system (CNS) dysfunctions, neurodegenerative diseases and neurotoxic injury following hypoxia, anoxia or ischemia of stroke, cardiac arrest or perinatal asphyxia; antipsychotic and -convulsant agents THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES 2003-12-02 — — US disclosed
US-6310064-B1 ADMINISTERING TO TREAT CEREBRAL ISCHEMIA OR A PSYCHOTIC DISORDER THE UNITED STATES OF AMERICA AS REPRESENTED BY THE OF DEPARTMENT OF HEALTH AND HUMAN SERVICES 2001-10-30 — — US disclosed
US-5656625-A ANTIISCHEMIC AGENT, PSYCHOLOGICAL DISORDER, ANTICONVULSANT THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1997-08-12 — — US disclosed
US-5571832-A Nitrogen-containing cyclohetero alkylamino aryl derivatives for CNS disorders THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1996-11-05 — — US disclosed
US-5346908-A Anticonvulsant NATIONAL INSTITUTES OF HEALTH (US) 1994-09-13 — — US disclosed
EP-0594597-A1 NITROGEN-CONTAINING CYCLOHETERO CYCLOALKYLAMINOARYL DERIVATIVES FOR CNS DISORDERS G.D. Searle & Co. (US) 1994-05-04 — — EP disclosed
WO-1994006794-A1 ARALKYL DIAZABICYCLOALKANE DERIVATIVES FOR CNS DISORDERS NATIONAL INSTITUTES OF HEALTH (US) 1994-03-31 — — WO disclosed
WO-1992004017-A1 CIS-N-(2-AMINOCYCLOHEXYL)BENZAMIDE AND THEIR ENANTIOMERS AS ANTICONVULSANTS THE UPJOHN COMPANY (US) 1992-03-19 — — WO disclosed
WO-1991012247-A1 NITROGEN-CONTAINING CYCLOHETERO CYCLOALKYLAMINOARYL DERIVATIVES FOR CNS DISORDERS G.D. SEARLE & CO. (US) 1991-08-22 — — WO disclosed
EP-0248824-B1 USE OF CIS-N-(2 AMINOCYCLOALIPHATIC) BENZENE ACETAMIDE AND BENZAMIDE FOR THE MANUFACTURE OF ANTICONVULSANTS THE UPJOHN COMPANY (US) 1990-01-17 — — EP disclosed
US-4801604-A REDUCED ANALGESIC PROPERTIES THE UPJOHN COMPANY (US) 1989-01-31 — — US disclosed
US-4801604-A REDUCED ANALGESIC PROPERTIES THE UPJOHN COMPANY (US) 1989-01-31 — — US disclosed
EP-0248824-A1 Use of CIS-N-(2 Aminocycloaliphatic) benzene acetamide and Benzamide for the manufacture of anticonvulsants. UPJOHN CO (US) 1987-12-16 — — EP disclosed
EP-0222533-A1 Cis-N-[(2-aminocycloaliphatic)benzene acetamide and -benzamide anticonvulsants THE UPJOHN COMPANY (US) 1987-05-20 — — EP disclosed
WO-1987002584-A1 CIS-N-(2-AMINOCYCLOALIPHATIC)BENZENE ACETAMIDE AND -BENZAMIDE ANTICONVULSANTS THE UPJOHN COMPANY (US) 1987-05-07 — — WO disclosed
Send feedback