SCHEMBL20043329

SCHEMBL20043329

O=Cc1c(-c2c(Cl)cccc2Cl)noc1C1CC1

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 20/20 0.48
FABP1 P07148 3/20 0.46
FABP4 P15090 1/20 0.44
HSD17B13 Q7Z5P4 1/20 0.43

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
SCHEMBL22790320 0.91 NR1H4 (0.43) NR1H4FABP1
SCHEMBL22790209 0.88 NR1H4 (0.45) NR1H4FABP1
SCHEMBL20952439 0.86 NR1H4 (0.46) NR1H4FABP1FABP4HSD17B13
SCHEMBL28417927 0.86 NR1H4 (0.46) NR1H4FABP1FABP4HSD17B13
SCHEMBL21326421 0.86 NR1H4 (0.48) NR1H4
SCHEMBL24638811 0.83 NR1H4 (0.39) NR1H4
SCHEMBL28895205 0.80 NR1H4 (0.51) NR1H4FABP1
SCHEMBL22789969 0.80 NR1H4 (0.47) NR1H4FABP1
SCHEMBL22789944 0.80 NR1H4 (0.53) NR1H4FABP1FABP4HSD17B13
SCHEMBL21693720 0.78 NR1H4 (0.46) NR1H4FABP1FABP4HSD17B13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111278821-B Spiro compounds as farnesol X receptor modulators 百时美施贵宝公司 2023-10-03 CN disclosed
US-20230295141-A1 FXR SMALL MOLECULE AGONIST, THE PREPARATION AND USE THEREOF CASCADE PHARMACEUTICALS, INC. (CN) 2023-09-21 US disclosed
US-20230295141-A1 FXR SMALL MOLECULE AGONIST, THE PREPARATION AND USE THEREOF CASCADE PHARMACEUTICALS, INC. (CN) 2023-09-21 US disclosed
EP-4245365-A1 A FXR SMALL MOLECULE AGONIST, THE PREPARATION AND USE THEREOF Cascade Pharmaceuticals, Inc. (CN) 2023-09-20 EP disclosed
EP-3535260-B1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUNDS AS FXR MODULATORS HEPAGENE THERAPEUTICS HK LTD (HK) 2023-08-30 EP disclosed
EP-3535260-B1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUNDS AS FXR MODULATORS HEPAGENE THERAPEUTICS HK LTD (HK) 2023-08-30 EP disclosed
CN-114315844-B FXR regulator and preparation method and application thereof 中国科学院上海药物研究所 2023-06-27 CN disclosed
CN-111511731-B Olefin compounds as modulators of the farnesol X receptor 百时美施贵宝公司 2023-05-23 CN disclosed
EP-3704106-B1 ALKENE COMPOUNDS AS FARNESOID X RECEPTOR MODULATORS BRISTOL MYERS SQUIBB CO (US) 2023-04-12 EP disclosed
CN-109963849-B Nitrogen-containing heterocyclic compounds as FXR modulators 和博医药有限公司 2023-03-28 CN disclosed
EP-3535260-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUNDS AS FXR MODULATORS Hepagene Therapeutics, Inc. (VG) 2019-09-11 EP disclosed
US-20190248752-A1 HETEROCYCLIC FXR MODULATORS Hepagene Therapeutics (HK) Limited (HK) 2019-08-15 US disclosed
US-20190194216-A1 ISOXAZOLE ANALOGS AS FXR AGONISTS AND METHODS OF USE THEREOF ENANTA PHARMACEUTICALS, INC. 2019-06-27 US disclosed
WO-2019118571-A1 ISOXAZOLE ANALOGS AS FXR AGONISTS AND METHODS OF USE THEREOF ENANTA PHARMACEUTICALS, INC. (US) 2019-06-20 WO disclosed
US-20190127362-A1 SPIROCYCLIC COMPOUNDS AS FARNESOID X RECEPTOR MODULATORS BRISTOL-MYERS SQUIBB COMPANY 2019-05-02 US disclosed
US-20190127362-A1 SPIROCYCLIC COMPOUNDS AS FARNESOID X RECEPTOR MODULATORS BRISTOL-MYERS SQUIBB COMPANY 2019-05-02 US disclosed
WO-2018075207-A1 HETEROCYCLIC FXR MODULATORS HEPAGENE THERAPEUTICS, INC. (VG) 2018-04-26 WO disclosed
US-20180099957-A1 ISOXAZOLE ANALOGS AS FXR AGONISTS AND METHODS OF USE THEREOF ENANTA PHARMACEUTICALS, INC. 2018-04-12 US disclosed
US-20180099957-A1 ISOXAZOLE ANALOGS AS FXR AGONISTS AND METHODS OF USE THEREOF ENANTA PHARMACEUTICALS, INC. 2018-04-12 US disclosed
WO-2018067704-A1 ISOXAZOLE ANALOGS AS FXR AGONISTS AND METHODS OF USE THEREOF ENANTA PHARMACEUTICALS, INC. (US) 2018-04-12 WO 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 (5 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-20190127362-A1 SPIROCYCLIC COMPOUNDS AS FARNESOID X RECEPTOR MODULATORS NR1H4, FXR1, NR1H2 NR1H4 1/4885FABP1 56/4885FABP4 487/4885
US-20180099957-A1 ISOXAZOLE ANALOGS AS FXR AGONISTS AND METHODS OF USE THEREOF GPBAR1, SLC10A1, NR1H4 NR1H4 3/4885FABP1 17/4885FABP4 394/4885
US-20190248752-A1 HETEROCYCLIC FXR MODULATORS NR1H4, FXR1, NR1H2 NR1H4 1/4885FABP1 12/4885FABP4 107/4885
US-20190194216-A1 ISOXAZOLE ANALOGS AS FXR AGONISTS AND METHODS OF USE THEREOF SLC10A1, NR1H4, GPBAR1 NR1H4 2/4885FABP1 42/4885FABP4 515/4885
US-20230295141-A1 FXR SMALL MOLECULE AGONIST, THE PREPARATION AND USE THEREOF FXR1, NR1H4, FXR2 NR1H4 2/4885FABP1 47/4885FABP4 605/4885

“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.