SCHEMBL3487778

SCHEMBL3487778

CC(C)(C)N1C(=O)C(Nc2ccc(N3CCCCC3)cc2)=C(c2ccccc2)S1(=O)=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 1.00
NR1H3 Q13133 1/20 1.00
NPC1 O15118 5/20 0.40
MAPT P10636 5/20 0.40
SMN1; SMN2 Q16637 4/20 0.40
RAB9A P51151 4/20 0.40
ALDH1A1 P00352 3/20 0.40
LMNA P02545 2/20 0.40
APAF1 O14727 2/20 0.40
TP53 P04637 1/20 0.40
PKM P14618 1/20 0.40
NFKB1 P19838 1/20 0.40
NFKB2 Q00653 1/20 0.40
RELA Q04206 1/20 0.40
MITF O75030 1/20 0.40
POLB P06746 1/20 0.40
HTT P42858 1/20 0.40
KLF5 Q13887 1/20 0.40
ADRA2A P08913 1/20 0.39
ADRA2C P18825 1/20 0.39

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
SCHEMBL3487077 1.00 NR1H2 (1.00) NR1H2NR1H3NPC1MAPTSMN1; SMN2
SCHEMBL3487794 0.99 NR1H2 (0.98) NR1H2NR1H3NPC1MAPTSMN1; SMN2
SCHEMBL3486754 0.90 NR1H2 (0.82) NR1H2NR1H3MAPTSMN1; SMN2ALDH1A1
SCHEMBL3488079 0.83 NR1H2 (0.71) NR1H2NR1H3NPC1MAPTSMN1; SMN2
SCHEMBL3488448 0.81 NR1H2 (0.68) NR1H2NR1H3NPC1MAPTSMN1; SMN2
SCHEMBL3487932 0.79 NR1H2 (0.65) NR1H2NR1H3MAPTSMN1; SMN2RAB9A
SCHEMBL3488864 0.79 NR1H2 (0.65) NR1H2NR1H3NPC1MAPTSMN1; SMN2
SCHEMBL3487298 0.77 NR1H2 (0.62) NR1H2NR1H3NPC1MAPTSMN1; SMN2
SCHEMBL3488247 0.76 NR1H2 (0.62) NR1H2NR1H3NPC1MAPTSMN1; SMN2
SCHEMBL3487254 0.75 NR1H2 (0.60) NR1H2NR1H3MAPTSMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4706644-A1 RECONSTITUTED HIGH-DENSITY LIPOPROTEIN NANOPARTICLES COMPRISING CHOLESTEROL Mepsgen Co., Ltd. (KR) 2026-03-11 EP claimed
CN-119112854-A Application of agonist for targeting LXR alpha in liver macrophages 中国人民解放军军事科学院军事医学研究院 2024-12-13 CN claimed
WO-2024228596-A1 RECONSTITUTED HIGH-DENSITY LIPOPROTEIN NANOPARTICLES COMPRISING CHOLESTEROL (주) 멥스젠 2024-11-07 WO claimed
EP-4373922-A1 METHODS AND COMPOSITIONS FOR GENERATING HUMAN MIDBRAIN NEURAL PROGENITOR CELLS Trailhead Biosystems Inc. (US) 2024-05-29 EP claimed
CN-117677691-A Methods and compositions for the generation of human midbrain neural progenitor cells 特雷尔赫德生物系统股份有限公司 2024-03-08 CN claimed
US-20230027059-A1 METHODS AND COMPOSITIONS FOR GENERATING HUMAN MIDBRAIN NEURAL PROGENITOR CELLS TRAILHEAD BIOSYSTEMS INC. 2023-01-26 US claimed
WO-2023003621-A1 METHODS AND COMPOSITIONS FOR GENERATING HUMAN MIDBRAIN NEURAL PROGENITOR CELLS TRAILHEAD BIOSYSTEMS INC. (US) 2023-01-26 WO claimed
EP-3999055-A1 METHODS FOR TREATING MEIBOMIAN GLAND DYSFUNCTION WITH LIVER X RECEPTOR AGONISTS Novartis AG (CH) 2022-05-25 EP claimed
US-20100016321-A1 DERIVATIVES OF ISOTHIAZOL-3(2H)-ONE 1,1-DIOXIDES AS LIVER X RECEPTOR MODULATOR ASTRAZENECA AB (SE) 2010-01-21 US claimed
US-7582629-B2 Derivatives of isothiazol-3(2H)-one 1,1-dioxides as liver X receptor modulators ASTRAZENECA AB (SE) 2009-09-01 US claimed
US-20080255122-A1 Derivatives of Isothiazol-3(2H)-One 1,1-Dioxides as Liver X Receptor Modulators ASTRAZENECA AB (SE) 2008-10-16 US claimed
EP-4706644-A1 RECONSTITUTED HIGH-DENSITY LIPOPROTEIN NANOPARTICLES COMPRISING CHOLESTEROL Mepsgen Co., Ltd. (KR) 2026-03-11 EP disclosed
EP-4558622-A1 METHODS AND COMPOSITIONS FOR GENERATING HUMAN MIDBRAIN DOPAMINERGIC NEURONS FROM NEURAL PROGENITOR CELLS Trailhead Biosystems Inc. (US) 2025-05-28 EP disclosed
CN-120051560-A Methods and compositions for generating human midbrain dopaminergic neurons from neural progenitor cells 特雷尔赫德生物系统股份有限公司 2025-05-27 CN disclosed
WO-2025059405-A1 COMPOSITIONS FOR USE IN A METHOD OF TREATING A MOTOR NEURON DISEASE OR CONDITION ASSOCIATED WITH A SPG11 PATHOGENIC VARIANT THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2025-03-20 WO disclosed
US-20220257596-A1 METHODS FOR TREATING MEIBOMIAN GLAND DYSFUNCTION WITH LIVER X RECEPTOR AGONISTS NOVARTIS AG (CH) 2022-08-18 US disclosed
EP-3999055-A1 METHODS FOR TREATING MEIBOMIAN GLAND DYSFUNCTION WITH LIVER X RECEPTOR AGONISTS Novartis AG (CH) 2022-05-25 EP disclosed
US-20100016321-A1 DERIVATIVES OF ISOTHIAZOL-3(2H)-ONE 1,1-DIOXIDES AS LIVER X RECEPTOR MODULATOR ASTRAZENECA AB (SE) 2010-01-21 US disclosed
US-7582629-B2 Derivatives of isothiazol-3(2H)-one 1,1-dioxides as liver X receptor modulators ASTRAZENECA AB (SE) 2009-09-01 US disclosed
US-20080255122-A1 Derivatives of Isothiazol-3(2H)-One 1,1-Dioxides as Liver X Receptor Modulators ASTRAZENECA AB (SE) 2008-10-16 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20220257596-A1 METHODS FOR TREATING MEIBOMIAN GLAND DYSFUNCTION WITH LIVER X RECEPTOR AGONISTS NR1H4, NR1H3, NR1H2 NR1H2 3/4885NR1H3 2/4885NPC1 233/4885
US-20100016321-A1 DERIVATIVES OF ISOTHIAZOL-3(2H)-ONE 1,1-DIOXIDES AS LIVER X RECEPTOR MODULATOR NR1H2, NR1H3, NR1I2 NR1H2 1/4885NR1H3 2/4885NPC1 98/4885
US-20080255122-A1 Derivatives of Isothiazol-3(2H)-One 1,1-Dioxides as Liver X Receptor Modulators NR1H2, NR1H3, NR1I2 NR1H2 1/4885NR1H3 2/4885NPC1 97/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.