SCHEMBL5201676

SCHEMBL5201676

NC(=O)C1(c2ccncc2)CCCCC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.51
HSD11B1 P28845 3/20 0.50
NPSR1 Q6W5P4 1/20 0.50
AKR1C1 Q04828 1/20 0.44
HDAC4 P56524 3/20 0.42
OPRM1 P35372 1/20 0.41
OPRL1 P41146 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
CYP19A1 P11511 1/20 0.40
ALDH1A1 P00352 4/20 0.39
HTT P42858 1/20 0.39
ALOX5 P09917 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
PRKAB2 O43741 1/20 0.36
PRKAG1 P54619 1/20 0.36
PRKAA2 P54646 1/20 0.36
PRKAA1 Q13131 1/20 0.36
PRKAG3 Q9UGI9 1/20 0.36
PRKAG2 Q9UGJ0 1/20 0.36

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
Hydrochloric Acid SCHEMBL29503797 0.98 LMNA (0.50) LMNAHSD11B1NPSR1AKR1C1HDAC4
Hydrochloric Acid SCHEMBL6503013 0.98 LMNA (0.50) LMNAHSD11B1NPSR1AKR1C1HDAC4
SCHEMBL89807 0.98 LMNA (0.51) LMNAHSD11B1NPSR1AKR1C1HDAC4
SCHEMBL10002396 0.94 LMNA (0.47) LMNAHSD11B1NPSR1AKR1C1HDAC4
SCHEMBL5200961 0.90 HSD11B1 (0.46) LMNAHSD11B1NPSR1AKR1C1OPRM1
Hydrochloric Acid SCHEMBL6504195 0.89 HSD11B1 (0.45) LMNAHSD11B1NPSR1AKR1C1OPRM1
SCHEMBL25422745 0.84 ALOX5 (0.45) LMNAHSD11B1NPSR1AKR1C1ALOX5
SCHEMBL29514621 0.83 AKR1C1 (0.66) LMNAHSD11B1NPSR1AKR1C1HDAC4
SCHEMBL8636689 0.82 OPRM1 (0.41) LMNAHSD11B1NPSR1OPRM1OPRL1
SCHEMBL4827944 0.81 AKR1C1 (0.68) LMNAHSD11B1NPSR1AKR1C1HDAC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4168536-A1 METHODS AND COMPOSITIONS FOR CULTIVATING PLURIPOTENT CELL SUSPENSIONS Life Technologies Corporation (US) 2023-04-26 EP claimed
US-20220145266-A1 METHODS RELATING TO INTESTINAL ORGAN-ON-A-CHIP PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2022-05-12 US disclosed
EP-3987006-A1 CELL CULTURE Agency For Science, Technology And Research (SG) 2022-04-27 EP disclosed
WO-2020256637-A1 CELL CULTURE AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2020-12-24 WO disclosed
EP-2938724-A1 CULTURING OF HUMAN EMBRYONIC STEM CELLS AT THE AIR-LIQUID INTERFACE FOR DIFFERENTIATION INTO PANCREATIC ENDOCRINE CELLS Janssen Biotech, Inc. (US) 2015-11-04 EP disclosed
WO-2014105543-A1 CULTURING OF HUMAN EMBRYONIC STEM CELLS AT THE AIR-LIQUID INTERFACE FOR DIFFERENTIATION INTO PANCREATIC ENDOCRINE CELLS JANSSEN BIOTECH, INC. (US) 2014-07-03 WO disclosed
CN-100422160-C Morpholine derivatives, process for their preparation and pharmaceutical compositions containing them SANOFI SYNTHELABO (FR) 2008-10-01 CN disclosed
EP-1150970-B1 (1-PHENACY-3-PHENYL-3-PIPERIDYLETHYL)PIPERIDINE DERIVATIVES, METHOD FOR THE PRODUCTION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME SANOFI AVENTIS (FR) 2007-08-22 EP disclosed
EP-1165528-B1 NOVEL MORPHOLINE DERIVATIVES, METHOD FOR THE PRODUCTION THEREOF AND PHARMACEUTICAL PREPARATIONS CONTAINING SAID DERIVATIVES SANOFI SYNTHELABO (FR) 2004-09-01 EP disclosed
CN-1353698-A Novel morpholine derivatives, method for production thereof and pharmaceutical preparations containing said derivatives SANOFI SYNTHELABO (FR) 2002-06-12 CN disclosed
EP-1165528-A1 NOVEL MORPHOLINE DERIVATIVES, METHOD FOR THE PRODUCTION THEREOF AND PHARMACEUTICAL PREPARATIONS CONTAINING SAID DERIVATIVES SANOFI-SYNTHELABO (FR) 2002-01-02 EP disclosed
EP-1150970-A1 (1-PHENACY-3-PHENYL-3-PIPERIDYLETHYL)PIPERIDINE DERIVATIVES, METHOD FOR THE PRODUCTION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME Sanofi-Aventis (FR) 2001-11-07 EP disclosed
WO-2000058292-A1 NOVEL MORPHOLINE DERIVATIVES, METHOD FOR THE PRODUCTION THEREOF AND PHARMACEUTICAL PREPARATIONS CONTAINING SAID DERIVATIVES SANOFI-SYNTHELABO (FR) 2000-10-05 WO disclosed
WO-2000047572-A1 (1-PHENACY-3-PHENYL-3-PIPERIDYLETHYL)PIPERIDINE DERIVATIVES, METHOD FOR THE PRODUCTION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME SANOFI-SYNTHELABO (FR) 2000-08-17 WO disclosed