SCHEMBL17584792

SCHEMBL17584792

CCCCOc1nc(O)cc(O)n1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.41
NR5A1 Q13285 1/20 0.41
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
GPR84 Q9NQS5 6/20 0.39
PTGS1 P23219 1/20 0.38
PTGS2 P35354 1/20 0.38
ESR1 P03372 5/20 0.37
MEN1 O00255 1/20 0.37
NPC1 O15118 1/20 0.37
ALDH1A1 P00352 1/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
RAB9A P51151 1/20 0.37
KMT2A Q03164 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
TLR8 Q9NR97 1/20 0.37
SMN1; SMN2 Q16637 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
SCHEMBL2459810 0.87 MCHR1 (0.39) LTA4HNR5A1CYP3A4CYP2D6MEN1
SCHEMBL11796953 0.82 NR5A1 (0.42) LTA4HNR5A1GPR84ESR1MEN1
SCHEMBL598441 0.82 CYP2D6 (0.43) LTA4HNR5A1CYP3A4CYP2D6PTGS1
SCHEMBL17585442 0.82 LTA4H (0.40) LTA4HNR5A1CYP3A4CYP2D6PTGS1
SCHEMBL11270818 0.81 LTA4H (0.42) LTA4HNR5A1CYP3A4CYP2D6PTGS1
SCHEMBL9065880 0.81 LTA4H (0.42) LTA4HNR5A1CYP3A4CYP2D6PTGS1
SCHEMBL2118007 0.80 MEN1 (0.41) LTA4HPTGS1PTGS2MEN1ALDH1A1
SCHEMBL7776188 0.78 MEN1 (0.39) LTA4HPTGS1PTGS2MEN1ALDH1A1
SCHEMBL4264141 0.77 MEN1 (0.43) LTA4HCYP3A4CYP2D6PTGS1PTGS2
SCHEMBL11277302 0.75 NR5A1 (0.46) LTA4HNR5A1GPR84TLR8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240150346-A1 CLASS OF HETEROAROMATIC COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF INNOVSTONE THERAPEUTICS LIMITED (CN) 2024-05-09 US disclosed
CN-117736210-A Aromatic heterocyclic compound, and preparation method and application thereof 上海翊石医药科技有限公司 2024-03-22 CN disclosed
EP-3848375-B1 METHODS OF PREPARING INTERMEDIATES FOR TOLL-LIKE RECEPTOR MODULATORS GILEAD SCIENCES INC (US) 2023-12-27 EP disclosed
CN-114805341-B Aromatic heterocyclic compound, and preparation method and application thereof 上海翊石医药科技有限公司 2023-12-08 CN disclosed
CN-115043840-A Methods for preparing TOLL-like receptor modulators 吉利德科学公司 2022-09-13 CN disclosed
WO-2022161420-A1 CLASS OF HETEROAROMATIC COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF 上海翊石医药科技有限公司 2022-08-04 WO disclosed
WO-2022161420-A1 CLASS OF HETEROAROMATIC COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF 上海翊石医药科技有限公司 2022-08-04 WO disclosed
CN-114805341-A Aromatic heterocyclic compounds and preparation method and application thereof 上海翊石医药科技有限公司 2022-07-29 CN disclosed
CN-107074860-B Methods for preparing TOLL-like receptor modulators 吉利德科学公司 2022-07-15 CN disclosed
EP-3848375-A1 METHODS OF PREPARING INTERMEDIATES FOR TOLL-LIKE RECEPTOR MODULATORS Gilead Sciences, Inc. (US) 2021-07-14 EP disclosed
EP-3848375-A1 METHODS OF PREPARING INTERMEDIATES FOR TOLL-LIKE RECEPTOR MODULATORS Gilead Sciences, Inc. (US) 2021-07-14 EP disclosed
EP-3461828-B1 METHODS OF PREPARING TOLL-LIKE RECEPTOR MODULATORS GILEAD SCIENCES INC (US) 2020-11-25 EP disclosed
EP-3461828-A2 METHODS OF PREPARING TOLL-LIKE RECEPTOR MODULATORS GILEAD SCIENCES, INC. (US) 2019-04-03 EP disclosed
EP-3194402-B1 METHODS OF PREPARING TOLL-LIKE RECEPTOR MODULATORS GILEAD SCIENCES INC (US) 2018-11-21 EP disclosed
EP-3194402-A1 METHODS OF PREPARING TOLL-LIKE RECEPTOR MODULATORS Gilead Sciences, Inc. (US) 2017-07-26 EP disclosed
US-9573952-B2 Methods of preparing toll-like receptor modulators GILEAD SCIENCES, INC. (US) 2017-02-21 US disclosed
US-9573952-B2 Methods of preparing toll-like receptor modulators GILEAD SCIENCES, INC. (US) 2017-02-21 US disclosed
WO-2016044183-A1 METHODS OF PREPARING TOLL-LIKE RECEPTOR MODULATORS GILEAD SCIENCES, INC. (US) 2016-03-24 WO disclosed
US-20160075707-A1 METHODS OF PREPARING TOLL-LIKE RECEPTOR MODULATORS GILEAD SCIENCES, INC. 2016-03-17 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 (2 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-20160075707-A1 METHODS OF PREPARING TOLL-LIKE RECEPTOR MODULATORS TLR3, TLR4, TLR6 LTA4H 539/4885NR5A1 3758/4885CYP3A4 3636/4885
US-20240150346-A1 CLASS OF HETEROAROMATIC COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF TLR7, TLR1, TLR8 LTA4H 608/4885NR5A1 297/4885CYP3A4 454/4885

“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.