SCHEMBL375420

SCHEMBL375420

Cn1cc(C(=O)O)nc1Br

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 1/20 0.45
PTGS1 P23219 1/20 0.38
PTGS2 P35354 1/20 0.38
KDM4E B2RXH2 5/20 0.37
ALOX15 P16050 3/20 0.37
TSHR P16473 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
ACMSD Q8TDX5 1/20 0.37
PTGER1 P34995 1/20 0.36
HIF1A Q16665 1/20 0.35
ALDH1A1 P00352 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
BRD4 O60885 1/20 0.34
MCL1 Q07820 2/20 0.33
GPR35 Q9HC97 1/20 0.32
HCAR2 Q8TDS4 1/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL27533910 0.83 HDAC8 (0.34) RXFP1ALDH1A1L3MBTL1SMN1; SMN2BRD4
SCHEMBL15322287 0.79 MAPT (0.40) KDM4EALDH1A1SMN1; SMN2BRD4
SCHEMBL21362773 0.77 PTGS1 (0.39) RXFP1PTGS1PTGS2KDM4EALOX15
SCHEMBL7489316 0.77 RXFP1 (0.42) RXFP1PTGS1PTGS2KDM4EALOX15
SCHEMBL25274273 0.77 RXFP1 (0.42) RXFP1PTGS1PTGS2KDM4EALOX15
SCHEMBL18776163 0.75 PTGS1 (0.38) RXFP1PTGS1PTGS2KDM4EALOX15
Hydrochloric Acid SCHEMBL31555571 0.75 RXFP1 (0.41) RXFP1PTGS1PTGS2KDM4EALOX15
SCHEMBL1051401 0.75 PTGER1 (0.39) RXFP1PTGS1PTGS2KDM4EALOX15
SCHEMBL28041713 0.75 RXFP1 (0.41) RXFP1PTGS1PTGS2KDM4EALOX15
SCHEMBL28041712 0.75 RXFP1 (0.41) RXFP1PTGS1PTGS2KDM4EALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107428732-B Substituted 2-thioimidazolyl carboxamides as pest control agents 拜耳作物科学股份公司 2020-09-08 CN disclosed
US-20190307126-A1 SUBSTITUTED 2-THIOIMIDAZOLYLCARBOXAMIDES AS PESTICIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2019-10-10 US disclosed
EP-3535258-A1 SUBSTITUTED BICYCLE HETEROCYCLIC DERIVATIVES USEFUL AS ROMK CHANNEL INHIBITORS Bristol-Myers Squibb Company (US) 2019-09-11 EP disclosed
EP-3256462-B1 SUBSTITUTED 2-THIOIMIDAZOLYL-CARBOXAMIDES AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2019-08-21 EP disclosed
US-10368545-B2 Substituted 2-thioimidazolylcarboxamides as pesticides BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2019-08-06 US disclosed
WO-2018093569-A1 SUBSTITUTED BICYCLE HETEROCYCLIC DERIVATIVES USEFUL AS ROMK CHANNEL INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2018-05-24 WO disclosed
US-20180007900-A1 SUBSTITUTED 2-THIOIMIDAZOLYLCARBOXAMIDES AS PESTICIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2018-01-11 US disclosed
US-20180007900-A1 SUBSTITUTED 2-THIOIMIDAZOLYLCARBOXAMIDES AS PESTICIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2018-01-11 US disclosed
EP-3256462-A1 SUBSTITUTED 2-THIOIMIDAZOLYL-CARBOXAMIDES AS PEST CONTROL AGENTS Bayer CropScience Aktiengesellschaft (DE) 2017-12-20 EP disclosed
WO-2016128298-A1 SUBSTITUTED 2-THIOIMIDAZOLYL-CARBOXAMIDES AS PEST CONTROL AGENTS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2016-08-18 WO disclosed
US-8623898-B2 Glycine transporter inhibiting substances TAISHO PHARMACEUTICAL CO., LTD. (JP) 2014-01-07 US disclosed
US-8623898-B2 Glycine transporter inhibiting substances TAISHO PHARMACEUTICAL CO., LTD. (JP) 2014-01-07 US disclosed
US-8623898-B2 Glycine transporter inhibiting substances TAISHO PHARMACEUTICAL CO., LTD. (JP) 2014-01-07 US disclosed
EP-2409976-A1 GLYCINE TRANSPORTER INHIBITOR Taisho Pharmaceutical Co., Ltd. (JP) 2012-01-25 EP disclosed
US-20120010414-A1 GLYCINE TRANSPORTER INHIBITING SUBSTANCES TAISHO PHARMACEUTICAL CO., LTD. (JP) 2012-01-12 US disclosed
US-20120010414-A1 GLYCINE TRANSPORTER INHIBITING SUBSTANCES TAISHO PHARMACEUTICAL CO., LTD. (JP) 2012-01-12 US disclosed
US-20120010414-A1 GLYCINE TRANSPORTER INHIBITING SUBSTANCES TAISHO PHARMACEUTICAL CO., LTD. (JP) 2012-01-12 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 (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-20120010414-A1 GLYCINE TRANSPORTER INHIBITING SUBSTANCES SLC18A2, SLC1A2, SLC6A1 RXFP1 1410/4885PTGS1 583/4885PTGS2 1034/4885
US-20190307126-A1 SUBSTITUTED 2-THIOIMIDAZOLYLCARBOXAMIDES AS PESTICIDES TSNAX, DDT, PTMS RXFP1 2900/4885PTGS1 3135/4885PTGS2 1780/4885
US-10368545-B2 Substituted 2-thioimidazolylcarboxamides as pesticides TSNAX, DDT, PTMS RXFP1 2900/4885PTGS1 3135/4885PTGS2 1780/4885
US-20180007900-A1 SUBSTITUTED 2-THIOIMIDAZOLYLCARBOXAMIDES AS PESTICIDES TSNAX, DDT, PTMS RXFP1 2900/4885PTGS1 3135/4885PTGS2 1780/4885

“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.