SCHEMBL5282659

SCHEMBL5282659

CCCn1nnc(Br)c1Br

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 3/20 0.44
SLC9A1 P19634 2/20 0.41
TOP2A P11388 1/20 0.39
ALDH1A1 P00352 2/20 0.37
ADORA2A P29274 1/20 0.34
ADORA2B P29275 1/20 0.34
GRIA4 P48058 1/20 0.33
HCAR3 P49019 1/20 0.33
CYP1A2 P05177 1/20 0.33

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
SCHEMBL5280549 0.87 GRM2 (0.47) GRM2SLC9A1TOP2AHCAR3
SCHEMBL5280496 0.84 SLC9A1 (0.47) GRM2SLC9A1TOP2AALDH1A1HCAR3
SCHEMBL5276690 0.81
SCHEMBL5280789 0.80 GRM2 (0.43) GRM2SLC9A1TOP2AALDH1A1ADORA2A
SCHEMBL5280505 0.80 GRM2 (0.43) GRM2SLC9A1TOP2AALDH1A1ADORA2A
SCHEMBL5279084 0.79 GRM2 (0.40) GRM2SLC9A1TOP2AALDH1A1ADORA2A
SCHEMBL5285694 0.79 GRM2 (0.40) GRM2SLC9A1TOP2AALDH1A1GRIA4
SCHEMBL5274680 0.79 GRM2 (0.40) GRM2SLC9A1TOP2AALDH1A1ADORA2A
SCHEMBL5277255 0.78 GRM2 (0.42) GRM2SLC9A1TOP2AALDH1A1GRIA4
SCHEMBL5285365 0.78 GRM2 (0.42) GRM2SLC9A1TOP2AALDH1A1GRIA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11999717-B2 Triazole carbamate pyridyl sulfonamides as LPA receptor antagonists and uses thereof GILEAD SCIENCES, INC. (US) 2024-06-04 US disclosed
CN-114728168-B Triazole carbamate pyridylsulfonamides as LPA receptor antagonists and their use 吉利德科学公司 2024-04-09 CN disclosed
US-20230212149-A1 TRIAZOLE CARBAMATE PYRIDYL SULFONAMIDES AS LPA RECEPTOR ANTAGONISTS AND USES THEREOF GILEAD SCIENCES, INC. 2023-07-06 US disclosed
US-20230212149-A1 TRIAZOLE CARBAMATE PYRIDYL SULFONAMIDES AS LPA RECEPTOR ANTAGONISTS AND USES THEREOF GILEAD SCIENCES, INC. 2023-07-06 US disclosed
US-20230212149-A1 TRIAZOLE CARBAMATE PYRIDYL SULFONAMIDES AS LPA RECEPTOR ANTAGONISTS AND USES THEREOF GILEAD SCIENCES, INC. 2023-07-06 US disclosed
US-11548871-B2 Triazole carbamate pyridyl sulfonamides as LPA receptor antagonists and uses thereof GILEAD SCIENCES, INC. (US) 2023-01-10 US disclosed
EP-4058144-A1 TRIAZOLE CARBAMATE PYRIDYL SULFONAMIDES AS LPA RECEPTOR ANTAGONISTS AND USES THEREOF Gilead Sciences, Inc. (US) 2022-09-21 EP disclosed
CN-114728168-A Triazolecarbamate pyridylsulfonamides as LPA receptor antagonists and their use 吉利德科学公司 2022-07-08 CN disclosed
US-20210171500-A1 TRIAZOLE CARBAMATE PYRIDYL SULFONAMIDES AS LPA RECEPTOR ANTAGONISTS AND USES THEREOF GILEAD SCIENCES, INC. 2021-06-10 US disclosed
WO-2021097039-A1 TRIAZOLE CARBAMATE PYRIDYL SULFONAMIDES AS LPA RECEPTOR ANTAGONISTS AND USES THEREOF GILEAD SCIENCES, INC. (US) 2021-05-20 WO disclosed
WO-2021097039-A1 TRIAZOLE CARBAMATE PYRIDYL SULFONAMIDES AS LPA RECEPTOR ANTAGONISTS AND USES THEREOF GILEAD SCIENCES, INC. (US) 2021-05-20 WO disclosed
US-10487063-B2 Preparation method for 1-substituted-1H-1,2,3-triazole 4-carboxylic acid ABA CHEMICALS (SHANGHAI) LIMITED (CN) 2019-11-26 US disclosed
US-20180029999-A1 Preparation Method for 1-substituted-1H-1,2,3-triazole 4-carboxylic acid ABA CHEMICALS (SHANGHAI) LIMITED (CN) 2018-02-01 US disclosed
US-20180029999-A1 Preparation Method for 1-substituted-1H-1,2,3-triazole 4-carboxylic acid ABA CHEMICALS (SHANGHAI) LIMITED (CN) 2018-02-01 US disclosed
WO-2013127028-A1 PREPARATION METHOD FOR 1-SUBSTITUTED-4-BROMINE-1H-1,2,3-TRIAZOLE-5-CARBOXYLIC ACID 苏州雅本化学股份有限公司 (CN) 2013-09-06 WO disclosed
EP-1859781-A2 Brightening and/or colouring agent with triazoles Henkel Kommanditgesellschaft auf Aktien (DE) 2007-11-28 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 (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-11548871-B2 Triazole carbamate pyridyl sulfonamides as LPA receptor antagonists and uses thereof LPAR3, LPAR1, LPAR2 GRM2 1914/4885SLC9A1 3696/4885TOP2A 4070/4885
US-10487063-B2 Preparation method for 1-substituted-1H-1,2,3-triazole 4-carboxylic acid CLIC1, GRIK1, CA3 GRM2 155/4885SLC9A1 595/4885TOP2A 1504/4885
US-11999717-B2 Triazole carbamate pyridyl sulfonamides as LPA receptor antagonists and uses thereof LPAR3, LPAR1, LPAR2 GRM2 1914/4885SLC9A1 3696/4885TOP2A 4070/4885
US-20210171500-A1 TRIAZOLE CARBAMATE PYRIDYL SULFONAMIDES AS LPA RECEPTOR ANTAGONISTS AND USES THEREOF LPAR3, LPAR1, LPAR2 GRM2 1914/4885SLC9A1 3696/4885TOP2A 4070/4885
US-20230212149-A1 TRIAZOLE CARBAMATE PYRIDYL SULFONAMIDES AS LPA RECEPTOR ANTAGONISTS AND USES THEREOF LPAR3, LPAR1, LPAR2 GRM2 1914/4885SLC9A1 3696/4885TOP2A 4070/4885
US-20180029999-A1 Preparation Method for 1-substituted-1H-1,2,3-triazole 4-carboxylic acid CLIC1, GRIK1, CA3 GRM2 155/4885SLC9A1 595/4885TOP2A 1504/4885

“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.