SCHEMBL255026

SCHEMBL255026

CC(CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3[C@H](O)CC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPC1L1 Q9UHC9 5/20 0.55
SHBG P04278 1/20 0.52
RORA P35398 3/20 0.52
MEN1 O00255 1/20 0.52
USP2 O75604 1/20 0.52
ALOX15 P16050 1/20 0.52
KMT2A Q03164 1/20 0.52
GPR183 P32249 4/20 0.51
RORC P51449 2/20 0.51
ALDH1A1 P00352 1/20 0.51
CYP3A4 P08684 4/20 0.51
PTPN1 P18031 1/20 0.51
CYP19A1 P11511 2/20 0.50
SRD5A1 P18405 1/20 0.48
SRD5A2 P31213 1/20 0.48
GPBAR1 Q8TDU6 1/20 0.48

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
SCHEMBL21449279 1.00 NPC1L1 (0.55) NPC1L1SHBGRORAMEN1USP2
SCHEMBL22968486 1.00 NPC1L1 (0.55) NPC1L1SHBGRORAMEN1USP2
SCHEMBL22968477 1.00 NPC1L1 (0.55) NPC1L1SHBGRORAMEN1USP2
SCHEMBL29139128 1.00 NPC1L1 (0.55) NPC1L1SHBGRORAMEN1USP2
SCHEMBL17971198 1.00 NPC1L1 (0.55) NPC1L1SHBGRORAMEN1USP2
SCHEMBL17394793 1.00 NPC1L1 (0.55) NPC1L1SHBGRORAMEN1USP2
SCHEMBL16574736 0.92 NPC1L1 (0.54) NPC1L1SHBGRORAMEN1USP2
SCHEMBL8383238 0.91 NPC1L1 (0.53) NPC1L1SHBGRORAMEN1USP2
SCHEMBL20995445 0.91 NPC1L1 (0.62) NPC1L1SHBGRORAMEN1USP2
SCHEMBL735215 0.91 NPC1L1 (0.62) NPC1L1SHBGRORAMEN1USP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025123045-A1 PREDICTIVE AND DIAGNOSTIC SCREENING METHODS FOR ENDOMETRIAL CANCER ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2025-06-12 WO claimed
WO-2024168236-A2 METHODS FOR DETECTING AND TREATING CAVERNOUS ANGIOMA THE UNIVERSITY OF CHICAGO (US) 2024-08-15 WO claimed
CN-112136043-B Mass spectrometry method for detecting and quantifying liver function metabolites 梅塔博隆股份有限公司 2024-03-22 CN claimed
CN-117405870-B Construction of predictive model of unstable plaque phenotype of coronary heart disease patient based on serum lipid metabolite 北京市心肺血管疾病研究所 2024-03-19 CN claimed
EP-3321686-B1 BIOMARKERS RELATED TO INSULIN RESISTANCE PROGRESSION AND METHODS USING THE SAME METABOLON INC (US) 2024-03-13 EP claimed
CN-117405870-A Construction of predictive model of unstable plaque phenotype of coronary heart disease patient based on serum lipid metabolite 北京市心肺血管疾病研究所 2024-01-16 CN claimed
US-20230375534-A1 MEANS AND METHODS TO DIAGNOSE GUT FLORA DYSBIOSIS AND INFLAMMATION VIB VZW (BE) 2023-11-23 US claimed
US-11536726-B2 Mass spectrometry assay method for detection and quantitation of liver function metabolites METABOLON, INC. (US) 2022-12-27 US claimed
US-11536730-B2 Methods for diagnosing motor neuron diseases SWANSEA UNIVERSITY (GB) 2022-12-27 US claimed
US-20190310269-A1 SYSTEMS AND METHODS FOR MEASURING OBESITY USING METABOLOME ANALYSIS HUMAN LONGEVITY, INC. 2019-10-10 US claimed
EP-2951313-A1 BIOMARKERS RELATED TO INSULIN RESISTANCE PROGRESSION AND METHODS USING THE SAME Metabolon, Inc. (US) 2015-12-09 EP claimed
US-20150285805-A1 BIOMARKERS OF MULTIPLE MYELOMA DEVELOPMENT AND PROGRESSION OSPEDALE SAN RAFFAELE SRL (IT) 2015-10-08 US claimed
EP-2914962-A1 BIOMARKERS OF MULTIPLE MYELOMA DEVELOPMENT AND PROGRESSION Ospedale San Raffaele S.r.l. (IT) 2015-09-09 EP claimed
WO-2014120449-A1 BIOMARKERS RELATED TO INSULIN RESISTANCE PROGRESSION AND METHODS USING THE SAME METABOLON, INC. (US) 2014-08-07 WO claimed
US-20140221236-A1 METABOLOMIC MARKERS FOR PRETERM BIRTH UNIVERSITY OF IOWA RESEARCH FOUNDATION 2014-08-07 US claimed
WO-2014068144-A1 BIOMARKERS OF MULTIPLE MYELOMA DEVELOPMENT AND PROGRESSION OSPEDALE SAN RAFFAELE S.R.L. (IT) 2014-05-08 WO claimed
US-8679457-B2 Metabolite biomarkers to distinguish Crohn's disease from ulcerative colitis and methods using the same METABOLON, INC. (US) 2014-03-25 US claimed
US-20120003158-A1 Biomarkers for Inflammatory Bowel Disease and Methods Using the Same METABOLON, INC. 2012-01-05 US claimed
US-20100273207-A1 Methods for Diagnosis of Sepsis and Risk of Death LANGLEY RAYMOND 2010-10-28 US claimed
WO-2010124269-A1 METHODS FOR DIAGNOSIS OF SEPSIS AND RISK OF DEATH NATIONAL CENTER FOR GENOME RESOURCES (US) 2010-10-28 WO claimed