SCHEMBL5331343

SCHEMBL5331343

CC[C@H]1CC[C@H](C(=O)Cl)CC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLG P00747 1/20 0.37
PLAT P00750 1/20 0.37
LMNA P02545 1/20 0.37
THRA P10827 1/20 0.34
THRB P10828 1/20 0.34
CYP19A1 P11511 1/20 0.33
OPRM1 P35372 1/20 0.33
EPHX2 P34913 1/20 0.33
IDH1 O75874 1/20 0.32
PKM P14618 2/20 0.32
ALDH1A1 P00352 2/20 0.32
POLB P06746 2/20 0.32
HPGD P15428 1/20 0.32
MAPT P10636 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
MEN1 O00255 2/20 0.30
KMT2A Q03164 2/20 0.30
HTT P42858 1/20 0.30
CNR1 P21554 1/20 0.30
CNR2 P34972 1/20 0.30

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
SCHEMBL5331350 1.00 PLG (0.37) PLGPLATLMNATHRATHRB
SCHEMBL2533711 0.94 PLG (0.33) PLGPLATLMNATHRATHRB
SCHEMBL10826339 0.94 PLG (0.33) PLGPLATLMNATHRATHRB
SCHEMBL10926810 0.94 PLG (0.33) PLGPLATLMNATHRATHRB
SCHEMBL16203169 0.84 CYP19A1 (0.41) CYP19A1POLBMAPTTDP1MEN1
SCHEMBL4482942 0.82 CYP2C9 (0.41) PLGPLATLMNATHRATHRB
SCHEMBL7522154 0.82 CYP2C9 (0.41) PLGPLATLMNATHRATHRB
Methylene Chloride SCHEMBL28166563 0.82
SCHEMBL11758964 0.80 LMNA (0.39) PLGPLATLMNATHRATHRB
SCHEMBL8774202 0.80

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230303526-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-09-28 US disclosed
US-11752128-B2 Benzimidazoles and indoles as taro inhibitors MERCK SHARP & DOHME CORPORATION (US) 2023-09-12 US disclosed
EP-3389785-B1 BENZIMIDAZOLES AND INDOLES AS TARO INHIBITORS MERCK SHARP & DOHME (US) 2023-08-16 EP disclosed
US-20210346344-A1 BENZIMIDAZOLES AND INDOLES AS TARO INHIBITORS MERCK SHARP & DOHME CORP. (US) 2021-11-11 US disclosed
US-11141403-B2 Benzimidazoles and indoles as taro inhibitors MERCK SHARP & DOHME CORP (US) 2021-10-12 US disclosed
US-20200261410-A1 BENZIMIDAZOLES AND INDOLES AS TARO INHIBITORS MERCK SHARP & DOHME CORP. (US) 2020-08-20 US disclosed
EP-3389785-A1 BENZIMIDAZOLES AND INDOLES AS TARO INHIBITORS Merck Sharp & Dohme Corp. (US) 2018-10-24 EP disclosed
WO-2017106134-A1 BENZIMIDAZOLES AND INDOLES AS TARO INHIBITORS MERCK SHARP & DOHME CORP. (US) 2017-06-22 WO disclosed
US-7816348-B2 Viral polymerase inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-10-19 US disclosed
US-20070219176-A1 Viral Polymerase Inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-09-20 US disclosed
WO-2007087717-A1 VIRAL POLYMERASE INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-08-09 WO disclosed
WO-2007039146-A1 4-CARBOXY PYRAZOLE DERIVATIVES AS ANTI-VIRAL AGENTS SMITHKLINE BEECHAM CORPORATION (US) 2007-04-12 WO disclosed
CN-1088453-C Fluorine-substituted liquid-crystal compound, liquid-crystal composition and liquid-crystal display device CHISSO CORP (JP) 2002-07-31 CN disclosed
EP-0820976-B1 FLUORINE-SUBSTITUTED LIQUID-CRYSTAL COMPOUND, LIQUID-CRYSTAL COMPOSITION AND LIQUID-CRYSTAL DISPLAY DEVICE CHISSO CORP (JP) 2001-02-21 EP disclosed
US-6051288-A LARGE DIELECTRIC ANISOTROPY, SMALL CHANGE IN THRESHOLD VOLTAGE DEPENDING ON TEMPERATURE, AND AN IMPROVED SOLUBILITY TO OTHER LIQUID CRYSTAL MATERIALS AT LOW TEMPERATURES CHISSO CORPORATION (JP) 2000-04-18 US disclosed
CN-1184462-A Fluorine-substituted liquid-crystal compound, liquid-crystal composition and liquid-crystal display device CHISSO CORP (JP) 1998-06-10 CN disclosed
EP-0820976-A1 FLUORINE-SUBSTITUTED LIQUID-CRYSTAL COMPOUND, LIQUID-CRYSTAL COMPOSITION AND LIQUID-CRYSTAL DISPLAY DEVICE CHISSO CORPORATION (JP) 1998-01-28 EP disclosed
US-4480117-A 1-(ALKYLCYCLOHEXYL-), 2-(ALKYLCYCLOHEXANECARBONYLOXYPHENYL-)ETHANE DAINIPPIN INK AND CHEMICALS, INC. (JP) 1984-10-30 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 (6 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-20070219176-A1 Viral Polymerase Inhibitors POLR2A, POLR2H, POLR2E PLG 2766/4885PLAT 928/4885LMNA 3643/4885
US-11141403-B2 Benzimidazoles and indoles as taro inhibitors CSDE1, IDO1, TMBIM6 PLG 4463/4885PLAT 4491/4885LMNA 3427/4885
US-20210346344-A1 BENZIMIDAZOLES AND INDOLES AS TARO INHIBITORS CSDE1, IDO1, TMBIM6 PLG 4463/4885PLAT 4491/4885LMNA 3427/4885
US-11752128-B2 Benzimidazoles and indoles as taro inhibitors CSDE1, IDO1, TMBIM6 PLG 4463/4885PLAT 4491/4885LMNA 3427/4885
US-20230303526-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 PLG 1441/4885PLAT 1236/4885LMNA 1656/4885
US-20200261410-A1 BENZIMIDAZOLES AND INDOLES AS TARO INHIBITORS CSDE1, IDO1, TMBIM6 PLG 4463/4885PLAT 4491/4885LMNA 3427/4885

“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.