SCHEMBL18640463

SCHEMBL18640463

COC(=O)C1CC(c2cccc(Br)c2)C1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 3/20 0.51
SLC6A3 Q01959 3/20 0.51
TSHR P16473 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
HDAC4 P56524 1/20 0.46
ALDH1A1 P00352 1/20 0.44
KDM1A O60341 3/20 0.42
RECQL P46063 2/20 0.41
LMNA P02545 1/20 0.41
POLB P06746 1/20 0.41
RCOR1 Q9UKL0 1/20 0.38
DRD2 P14416 1/20 0.38
DRD1 P21728 1/20 0.38
DRD4 P21917 1/20 0.38
DRD5 P21918 1/20 0.38
DRD3 P35462 1/20 0.38
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
HTR2B P41595 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL30967779 1.00 SLC6A4 (0.51) SLC6A4SLC6A3TSHRNPSR1HDAC4
SCHEMBL22945326 0.89 SLC6A4 (0.43) SLC6A4SLC6A3TSHRNPSR1HDAC4
SCHEMBL23380763 0.83 SLC6A4 (0.45) SLC6A4SLC6A3TSHRNPSR1HDAC4
SCHEMBL21512715 0.82 GRIN2B (0.42) SLC6A3
SCHEMBL21512714 0.82 OPRK1 (0.43) HDAC4ALDH1A1LMNADRD4KMT2A
SCHEMBL29969542 0.82 OPRK1 (0.43) HDAC4ALDH1A1LMNADRD4KMT2A
SCHEMBL29969842 0.82 GRIN2B (0.42) SLC6A3
SCHEMBL18640459 0.82 POLB (0.40) SLC6A4SLC6A3TSHRALDH1A1POLB
SCHEMBL30015707 0.81 KDM1A (0.51) TSHRNPSR1HDAC4KDM1ARCOR1
SCHEMBL15192136 0.81 SLC6A3 (0.48) SLC6A4SLC6A3TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12291523-B2 LXR modulators with bicyclic core moiety ORSOBIO, INC. (US) 2025-05-06 US disclosed
US-20240317726-A1 NOVEL LXR MODULATORS WITH BICYCLIC CORE MOIETY ORSOBIO, INC. 2024-09-26 US disclosed
US-20240279220-A1 INDOLE COMPOUNDS AND METHODS OF USE SIONNA THERAPEUTICS INC. 2024-08-22 US disclosed
EP-4396179-A1 INDOLE COMPOUNDS AND METHODS OF USE GENZYME CORPORATION (US) 2024-07-10 EP disclosed
CN-118201919-A Indole compounds and methods of use 健赞公司 2024-06-14 CN disclosed
US-11970484-B2 LXR modulators with bicyclic core moiety ORSOBIO, INC. (US) 2024-04-30 US disclosed
US-20230357214-A1 NOVEL LXR MODULATORS WITH BICYCLIC CORE MOIETY PHENEX PHARMACEUTICALS AKTIENGESELLSCHAFT (DE) 2023-11-09 US disclosed
US-20230357214-A1 NOVEL LXR MODULATORS WITH BICYCLIC CORE MOIETY PHENEX PHARMACEUTICALS AKTIENGESELLSCHAFT (DE) 2023-11-09 US disclosed
US-20230357214-A1 NOVEL LXR MODULATORS WITH BICYCLIC CORE MOIETY PHENEX PHARMACEUTICALS AKTIENGESELLSCHAFT (DE) 2023-11-09 US disclosed
EP-3814331-B9 NOVEL LXR MODULATORS WITH BICYCLIC CORE MOIETY ORSOBIO INC (US) 2023-08-09 EP disclosed
CN-108349893-B Farnesoid X receptor agonists and uses thereof 梅塔克林公司 2021-12-28 CN disclosed
US-20210147398-A1 NOVEL LXR MODULATORS WITH BICYCLIC CORE MOIETY PHENEX-FXR GMBH (DE) 2021-05-20 US disclosed
US-20210147398-A1 NOVEL LXR MODULATORS WITH BICYCLIC CORE MOIETY PHENEX-FXR GMBH (DE) 2021-05-20 US disclosed
CN-112689630-A Novel LXR modulators with bicyclic core moieties 菲尼克斯-FXR股份有限公司 2021-04-20 CN disclosed
US-20210032195-A1 FARNESOID X RECEPTOR AGONISTS AND USES THEREOF ELI LILLY AND COMPANY 2021-02-04 US disclosed
US-10703712-B2 Farnesoid X receptor agonists and uses thereof METACRINE, INC. (US) 2020-07-07 US disclosed
US-20180282263-A1 FARNESOID X RECEPTOR AGONISTS AND USES THEREOF ELI LILLY AND COMPANY 2018-10-04 US disclosed
EP-3350165-A1 FARNESOID X RECEPTOR AGONISTS AND USES THEREOF Metacrine, Inc. (US) 2018-07-25 EP disclosed
WO-2017049173-A1 FARNESOID X RECEPTOR AGONISTS AND USES THEREOF METACRINE, INC. (US) 2017-03-23 WO disclosed
WO-2017049173-A1 FARNESOID X RECEPTOR AGONISTS AND USES THEREOF METACRINE, INC. (US) 2017-03-23 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 (9 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-20240279220-A1 INDOLE COMPOUNDS AND METHODS OF USE CFTR, INMT, IDO1 SLC6A4 25/4885SLC6A3 71/4885TSHR 2973/4885
US-20240317726-A1 NOVEL LXR MODULATORS WITH BICYCLIC CORE MOIETY NR1H2, NR1H3, NCOA3 SLC6A4 2320/4885SLC6A3 2749/4885TSHR 413/4885
US-20210032195-A1 FARNESOID X RECEPTOR AGONISTS AND USES THEREOF NR1H4, NR1H2, NR1H3 SLC6A4 4121/4885SLC6A3 4484/4885TSHR 365/4885
US-10703712-B2 Farnesoid X receptor agonists and uses thereof NR1H4, NR1H2, NR1H3 SLC6A4 4121/4885SLC6A3 4484/4885TSHR 365/4885
US-12291523-B2 LXR modulators with bicyclic core moiety NR1H2, NR1H3, NR1H4 SLC6A4 2595/4885SLC6A3 3203/4885TSHR 362/4885
US-11970484-B2 LXR modulators with bicyclic core moiety NR1H2, NR1H3, NR1H4 SLC6A4 2766/4885SLC6A3 4458/4885TSHR 364/4885
US-20180282263-A1 FARNESOID X RECEPTOR AGONISTS AND USES THEREOF NR1H4, NR1H2, NR1H3 SLC6A4 4121/4885SLC6A3 4484/4885TSHR 365/4885
US-20210147398-A1 NOVEL LXR MODULATORS WITH BICYCLIC CORE MOIETY NR1H2, NR1H3, NR1H4 SLC6A4 2612/4885SLC6A3 4309/4885TSHR 424/4885
US-20230357214-A1 NOVEL LXR MODULATORS WITH BICYCLIC CORE MOIETY NR1H2, NR1H3, NR1H4 SLC6A4 2612/4885SLC6A3 4309/4885TSHR 424/4885

“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.