SCHEMBL1702342

SCHEMBL1702342

FC1(F)Oc2cc(Cl)c(Br)cc2O1

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
AHR P35869 5/20 0.58
ALPL P05186 1/20 0.36
FLT1 P17948 1/20 0.33
GPR3 P46089 1/20 0.33
STIM1 Q13586 2/20 0.33
ORAI1 Q96D31 2/20 0.33
AKR1B1 P15121 1/20 0.31
CSNK2A1 P68400 1/20 0.31
CTNNB1 P35222 1/20 0.30
WNT3A P56704 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
SCHEMBL29394000 1.00 AHR (0.58) AHRALPLFLT1GPR3STIM1
SCHEMBL8759431 0.84 ALPL (0.48) AHRALPLFLT1GPR3STIM1
SCHEMBL1752066 0.84 AHR (0.48) AHRGPR3CTNNB1WNT3A
SCHEMBL3342338 0.78 MEN1 (0.38) AHRGPR3CTNNB1WNT3A
SCHEMBL30177616 0.78 MEN1 (0.38) AHRGPR3CTNNB1WNT3A
SCHEMBL1702010 0.77 AHR (0.47) AHRALPL
SCHEMBL17244773 0.76 STIM1 (0.39) AHRALPLFLT1GPR3STIM1
SCHEMBL755256 0.76 GAA (0.48) AHRALPLFLT1GPR3STIM1
SCHEMBL17543892 0.76 AHR (0.35) AHRGPR3STIM1ORAI1AKR1B1
SCHEMBL30714928 0.75 ALPL (0.34) AHRALPLFLT1GPR3STIM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12522589-B2 Synthesis of CRAC channel inhibitors CALCIMEDICA, INC. (US) 2026-01-13 US disclosed
US-11905248-B2 Compounds that modulate intracellular calcium CALCIMEDICA, INC. (US) 2024-02-20 US disclosed
US-20240010638-A1 IMPROVED SYNTHESIS OF CRAC CHANNEL INHIBITORS AVENUE CAPITAL MANAGEMENT II, L.P. 2024-01-11 US disclosed
US-11839613-B2 Pyrimidine derivatives as PGE2 receptor modulators IDORSIA PHARMACEUTICALS LTD (CH) 2023-12-12 US disclosed
EP-2970185-B1 4-AMINO-6-(HETEROCYCLIC)PICOLINATES AND 6-AMINO-2-(HETEROCYCLIC)PYRIMIDINE-4-CARBOXYLATES AND THEIR USE AS HERBICIDES CORTEVA AGRISCIENCE LLC (US) 2023-07-12 EP disclosed
US-20230017045-A1 PYRIDINE AND PYRIMIDINE CARBOXYLATE HERBICIDES AND METHODS OF USE THEREOF DOW AGROSCIENCES LLC (US) 2023-01-19 US disclosed
WO-2022101654-A1 IMPROVED SYNTHESIS OF CRAC CHANNEL INHIBITORS CALCIMEDICA, INC. (US) 2022-05-19 WO disclosed
EP-2563759-B1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA INC (US) 2022-04-06 EP disclosed
EP-3965760-A1 SYNTHESIS OF CRAC CHANNEL INHIBITORS Calcimedica, Inc. (US) 2022-03-16 EP disclosed
US-20220056053-A1 SYNTHESIS OF CRAC CHANNEL INHIBITORS AVENUE CAPITAL MANAGEMENT II, L.P. 2022-02-24 US disclosed
EP-2563776-A2 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM Calcimedica, Inc. (US) 2013-03-06 EP disclosed
WO-2011139489-A2 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA INC. (US) 2011-11-10 WO disclosed
WO-2011139489-A2 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA INC. (US) 2011-11-10 WO disclosed
US-20110263612-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA, INC. (US) 2011-10-27 US disclosed
US-20110263612-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA, INC. (US) 2011-10-27 US disclosed
US-20110263612-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA, INC. (US) 2011-10-27 US disclosed
EP-1595877-B1 Process for the preparation of 5-bromo-2,2-difluorobenzo-(1,3)-dioxoles SALTIGO GMBH (DE) 2009-03-11 EP disclosed
US-7148365-B2 Process for preparing 5-bromo-2,2-difluorobenzo-1,3-dioxoles LANXESS DEUTSCHLAND GMBH (DE) 2006-12-12 US disclosed
US-20050272942-A1 Process for preparing 5-bromo-2,2-difluorobenzo-1,3-dioxoles LANXESS DEUTSCHLAND GMBH (DE) 2005-12-08 US disclosed
EP-1595877-A1 Process for the preparation of 5-bromo-2,2-difluorobenzo-(1,3)-dioxoles Lanxess Deutschland GmbH (DE) 2005-11-16 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 (7 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-20050272942-A1 Process for preparing 5-bromo-2,2-difluorobenzo-1,3-dioxoles BROX, DCPS, CYP4X1 AHR 1400/4885ALPL 1017/4885FLT1 2755/4885
US-11839613-B2 Pyrimidine derivatives as PGE2 receptor modulators PTGER1, PTGER4, PTGER2 AHR 371/4885ALPL 4772/4885FLT1 1677/4885
US-20240010638-A1 IMPROVED SYNTHESIS OF CRAC CHANNEL INHIBITORS CACNA1E, CACNA1C, ORAI1 AHR 2901/4885ALPL 4805/4885FLT1 4562/4885
US-20230017045-A1 PYRIDINE AND PYRIMIDINE CARBOXYLATE HERBICIDES AND METHODS OF USE THEREOF PDXK, DPYD, DDT AHR 166/4885ALPL 2550/4885FLT1 1216/4885
US-20110263612-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM ORAI1, SARAF, RYR2 AHR 3487/4885ALPL 4016/4885FLT1 4830/4885
US-20220056053-A1 SYNTHESIS OF CRAC CHANNEL INHIBITORS CACNA1E, CACNA1C, ORAI1 AHR 3545/4885ALPL 4789/4885FLT1 4526/4885
US-11905248-B2 Compounds that modulate intracellular calcium ORAI1, SARAF, RYR2 AHR 3487/4885ALPL 4016/4885FLT1 4830/4885

“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.