SCHEMBL20554184

SCHEMBL20554184

COC(=O)c1cc(F)c2nc(Cl)sc2c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.51
MAPT P10636 4/20 0.51
KMT2A Q03164 4/20 0.51
LMNA P02545 3/20 0.51
GAA P10253 3/20 0.51
MEN1 O00255 3/20 0.51
ALDH1A1 P00352 3/20 0.51
TNF P01375 2/20 0.51
HPGD P15428 2/20 0.51
HTT P42858 2/20 0.51
MCL1 Q07820 2/20 0.51
NOD1 Q9Y239 2/20 0.51
NOD2 Q9HC29 1/20 0.51
KDM4E B2RXH2 4/20 0.42
NR2F2 P24468 1/20 0.42
KLF5 Q13887 1/20 0.42
NR1H4 Q96RI1 3/20 0.42
POLB P06746 2/20 0.41
NFKB1 P19838 1/20 0.40
XDH P47989 1/20 0.40

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
SCHEMBL21326445 0.85 KDM4E (0.44) SMN1; SMN2MAPTKMT2ALMNAGAA
SCHEMBL28548830 0.85 RAB9A (0.45) SMN1; SMN2MAPTKMT2ALMNAGAA
SCHEMBL20839867 0.84 HDAC1 (0.43) SMN1; SMN2MAPTKMT2ALMNAGAA
SCHEMBL9952440 0.84 KDM4E (0.42) SMN1; SMN2MAPTKMT2ALMNAGAA
SCHEMBL2275524 0.84 SMN1; SMN2 (0.55) SMN1; SMN2MAPTKMT2ALMNAGAA
SCHEMBL21984979 0.83 LMNA (0.51) SMN1; SMN2MAPTKMT2ALMNAGAA
SCHEMBL9951657 0.83 ALDH1A1 (0.50) SMN1; SMN2MAPTKMT2ALMNAGAA
SCHEMBL2275450 0.83 LMNA (0.51) SMN1; SMN2MAPTKMT2ALMNAGAA
SCHEMBL20554157 0.82 NR1H4 (0.39) LMNAGAANR1H4
SCHEMBL21262000 0.80 LMNA (0.48) SMN1; SMN2MAPTKMT2ALMNAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3535260-B1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUNDS AS FXR MODULATORS HEPAGENE THERAPEUTICS HK LTD (HK) 2023-08-30 EP disclosed
CN-110818704-B Spiro bridged ring compounds, pharmaceutical compositions thereof and uses thereof 广州市恒诺康医药科技有限公司 2023-08-01 CN disclosed
US-20210079006-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUNDS AS FXR MODULATORS HEPAGENE THERAPEUTICS HK LTD (HK) 2021-03-18 US disclosed
US-10919903-B2 Nitrogen-containing heterocyclic compounds as FXR modulators Hepagene Therapeutics (HK) Limited (HK) 2021-02-16 US disclosed
CN-110818704-A Spiro-bridged ring compounds, pharmaceutical compositions thereof and uses thereof 广州市恒诺康医药科技有限公司 2020-02-21 CN disclosed
US-20190276465-A1 Nitrogen-Containing Heterocyclic Compounds As FXR Modulators Hepagene Therapeutics (HK) Limited (HK) 2019-09-12 US disclosed
US-20190002452-A1 FXR RECEPTOR MODULATOR, PREPARATION METHOD THEREFOR, AND USES THEREOF GUANGZHOU HENOVCOM BIOSCIENCE CO. LTD. (CN) 2019-01-03 US disclosed
EP-3401315-A1 FXR RECEPTOR MODULATOR, PREPARATION METHOD THEREFOR, AND USES THEREOF Guangzhou Henovcom Bioscience Co. Ltd. (CN) 2018-11-14 EP 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 (4 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-20190276465-A1 Nitrogen-Containing Heterocyclic Compounds As FXR Modulators NR1H4, FXR1, FXR2 SMN1; SMN2 4820/4885MAPT 3342/4885KMT2A 3452/4885
US-20190002452-A1 FXR RECEPTOR MODULATOR, PREPARATION METHOD THEREFOR, AND USES THEREOF NR1H4, FXR1, GPBAR1 SMN1; SMN2 4837/4885MAPT 3695/4885KMT2A 3129/4885
US-10919903-B2 Nitrogen-containing heterocyclic compounds as FXR modulators NR1H4, FXR1, FXR2 SMN1; SMN2 4820/4885MAPT 3342/4885KMT2A 3452/4885
US-20210079006-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUNDS AS FXR MODULATORS NR1H4, FXR1, FXR2 SMN1; SMN2 4820/4885MAPT 3342/4885KMT2A 3452/4885

“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.