SCHEMBL4445751

SCHEMBL4445751

Oc1cccc(-c2ccccc2Cl)c1O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.54
TSHR P16473 2/20 0.50
HPGD P15428 4/20 0.48
HSD17B10 Q99714 4/20 0.48
ALOX15 P16050 3/20 0.48
LMNA P02545 3/20 0.48
EGFR P00533 2/20 0.48
CA2 P00918 2/20 0.48
FYN P06241 2/20 0.48
MMP9 P14780 2/20 0.48
RECQL P46063 2/20 0.48
TDP1 Q9NUW8 2/20 0.48
ADAMTS4 O75173 1/20 0.48
CA1 P00915 1/20 0.48
MMP2 P08253 1/20 0.48
MMP8 P22894 1/20 0.48
CA6 P23280 1/20 0.48
CDK2 P24941 1/20 0.48
MMP12 P39900 1/20 0.48
ADAMTS5 Q9UNA0 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
SCHEMBL30335991 0.88 CYP2A6 (0.50) ALDH1A1TSHRHPGDLMNAPIK3CA
SCHEMBL932318 0.86 IDO1 (0.50) ALDH1A1TSHRHPGDLMNAPIK3CA
SCHEMBL9796905 0.84 TSHR (0.60) ALDH1A1TSHRHPGDHSD17B10ALOX15
SCHEMBL1022489 0.83 ALDH1A1 (0.62) ALDH1A1TSHRHPGDHSD17B10ALOX15
SCHEMBL29807938 0.83 ALDH1A1 (0.62) ALDH1A1TSHRHPGDHSD17B10ALOX15
SCHEMBL9973588 0.83 HPGD (0.61) ALDH1A1TSHRHPGDHSD17B10ALOX15
SCHEMBL337585 0.83 ALDH1A1 (0.69) ALDH1A1TSHRHPGDHSD17B10ALOX15
SCHEMBL29453072 0.83 ALDH1A1 (0.69) ALDH1A1TSHRHPGDHSD17B10ALOX15
SCHEMBL1513821 0.82 TSHR (0.62) ALDH1A1TSHRHPGDHSD17B10ALOX15
SCHEMBL3486669 0.82 TSHR (0.50) ALDH1A1TSHRHPGDHSD17B10ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3681504-B1 METHODS OF DETECTION USING X-RAY FLUORESCENCE ICAGEN INC (US) 2023-08-23 EP disclosed
US-11573224-B2 Methods of detection using X-ray fluorescence ICAGEN, LLC (US) 2023-02-07 US disclosed
US-11446398-B2 Regulated biocircuit systems OBSIDIAN THERAPEUTICS, INC. (US) 2022-09-20 US disclosed
US-20210254056-A1 IDENTIFICATION AND TARGETED MODULATION OF GENE SIGNALING NETWORKS CAMP4 THERAPEUTICS CORPORATION 2021-08-19 US disclosed
US-10877035-B2 Advanced drug development and manufacturing ICAGEN, LLC (US) 2020-12-29 US disclosed
US-20200278346-A1 METHODS OF DETECTION USING X-RAY FLUORESCENCE ADJACENT ACQUISITION CO., LLC 2020-09-03 US disclosed
EP-3681504-A1 METHODS OF DETECTION USING X-RAY FLUORESCENCE Icagen, Inc. (US) 2020-07-22 EP disclosed
US-20190192691-A1 REGULATED BIOCIRCUIT SYSTEMS OBSIDIAN THERAPEUTICS, INC. 2019-06-27 US disclosed
WO-2019055754-A1 METHODS OF DETECTION USING X-RAY FLUORESCENCE ICAGEN, INC. (US) 2019-03-21 WO disclosed
WO-2018204764-A1 IDENTIFICATION AND TARGETED MODULATION OF GENE SIGNALING NETWORKS CAMP4 THERAPEUTICS CORPORATION (US) 2018-11-08 WO disclosed
US-20150309021-A1 Advanced Drug Development and Manufacturing LOS ALAMOS NATIONAL SECURITY, LLC 2015-10-29 US disclosed
EP-2511844-B1 X-ray microscope XRPRO SCIENCES INC (US) 2015-08-12 EP disclosed
EP-2511844-A2 Advanced drug development and manufacturing Los Alamos National Security, LLC (US) 2012-10-17 EP disclosed
EP-2084519-B1 X-RAY FLUORESCENCE ANALYSIS METHOD LOS ALAMOS NAT SECURITY LLC (US) 2012-08-01 EP disclosed
EP-2084519-A2 ADVANCED DRUG DEVELOPMENT AND MANUFACTURING Los Alamos National Security, LLC (US) 2009-08-05 EP disclosed
WO-2008127291-A2 ADVANCED DRUG DEVELOPMENT AND MANUFACTURING LOS ALAMOS NATIONAL SECURITY, LLC (US) 2008-10-23 WO disclosed
US-20080220441-A1 Advanced drug development and manufacturing THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2008-09-11 US disclosed