SCHEMBL8047355

SCHEMBL8047355

FC(F)Oc1ccccc1Cl

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.50
LMNA P02545 5/20 0.44
MAPT P10636 5/20 0.44
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
HTT P42858 2/20 0.44
TP53 P04637 1/20 0.44
HTR1E P28566 1/20 0.44
S1PR3 Q99500 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
SMN1; SMN2 Q16637 3/20 0.42
NPC1 O15118 1/20 0.42
NFKB1 P19838 1/20 0.42
RAB9A P51151 1/20 0.42
NFKB2 Q00653 1/20 0.42
RELA Q04206 1/20 0.42
DRD1 P21728 1/20 0.42
ADRA2A P08913 1/20 0.41
ADRA2B P18089 1/20 0.41
ADRA2C P18825 1/20 0.41

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
SCHEMBL19337474 0.82 ADRA2A (0.42) ALDH1A1LMNAMAPTKMT2AMEN1
SCHEMBL4654255 0.82 DRD1 (0.48) ALDH1A1MAPTKMT2AHTTL3MBTL1
SCHEMBL900624 0.79 ALDH1A1 (0.49) ALDH1A1LMNAMAPTKMT2AMEN1
SCHEMBL18189403 0.79 ALDH1A1 (0.45) ALDH1A1LMNAMAPTKMT2AMEN1
SCHEMBL25044027 0.79 ALDH1A1 (0.45) ALDH1A1LMNAMAPTKMT2AMEN1
SCHEMBL23326007 0.79 ALDH1A1 (0.45) ALDH1A1LMNAMAPTKMT2AMEN1
SCHEMBL30017347 0.79 ALDH1A1 (0.45) ALDH1A1LMNAMAPTKMT2AMEN1
SCHEMBL900625 0.79 ALDH1A1 (0.45) ALDH1A1LMNAMAPTKMT2AMEN1
SCHEMBL28531282 0.78 LMNA (0.43) ALDH1A1LMNAMAPTKMT2AMEN1
SCHEMBL220092 0.76 ADRA2A (0.49) ALDH1A1LMNAMAPTKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-6263678-A None JP disclosed
US-11760701-B2 Difluoromethoxylation and trifluoromethoxylation compositions and methods for synthesizing same THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YROK (US) 2023-09-19 US disclosed
US-11760701-B2 Difluoromethoxylation and trifluoromethoxylation compositions and methods for synthesizing same THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YROK (US) 2023-09-19 US disclosed
US-20210032181-A1 DIFLUOROMETHOXYLATION AND TRIFLUOROMETHOXYLATION COMPOSITIONS AND METHODS FOR SYNTHESIZING SAME THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2021-02-04 US disclosed
US-20200121677-A1 SUBSTITUTED 6,7-DIHYDROPYRAZOLO[1,5-a]PYRAZINES AS NEGATIVE ALLOSTERIC MODULATORS OF MGLUR2 RECEPTORS JANSSEN PHARMACEUTICA NV (US) 2020-04-23 US disclosed
US-20190055257-A1 SUBSTITUTED 6,7-DIHYDROPYRAZOLO[1,5-a]PYRAZINES AS NEGATIVE ALLOSTERIC MODULATORS OF MGLUR2 RECEPTORS JANSSEN PHARMACEUTICA NV (BE) 2019-02-21 US disclosed
CN-108430471-A Factor xia inhibitors 默沙东公司 2018-08-21 CN disclosed
US-10005786-B2 Substituted 6,7-dihydropyrazolo[1,5-a]pyrazines as negative allosteric modulators of MGLUR2 receptors JANSSEN PHARMACEUTICA NV (BE) 2018-06-26 US disclosed
US-10005785-B2 Substituted 6,7-dihydropyrazolo[1,5-a] pyrazines as negative allosteric modulators of mGlUR2 receptors JANSSEN PHARMACEUTICA NV (BE) 2018-06-26 US disclosed
CN-104910161-B Pyrazolopyrimidine compound and method as JAK inhibitor 健泰科生物技术公司 2018-03-30 CN disclosed
CN-102884047-B 2-pyridone compounds NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2015-11-25 CN disclosed
CN-102482284-B Pyrazolopyrimidine compounds and methods as JAK inhibitors GENENTECH, INC. (US) 2015-11-25 CN disclosed
CN-104910161-A Pyrazolopyrimidine JAK inhibitor compounds and methods GENENTECH INC 2015-09-16 CN disclosed
CN-104119238-A Preparation method for 4-(chlorodifluoromethoxy)aniline KINGCHEM LIAONING CHEMICAL CO LTD 2014-10-29 CN disclosed
US-20120232265-A1 1,2-Disubstituted Heterocyclic Compounds ENVIVO PHARMACEUTICALS, INC. 2012-09-13 US disclosed
CN-102482284-A Pyrazolopyrimidine compounds and methods as JAK inhibitors GENENTECH INC 2012-05-30 CN disclosed
WO-2000075093-A1 METHOD OF MAKING α,α,α-TRIFLUOROMETHOXYBENZENES OCCIDENTAL CHEMICAL CORPORATION (US) 2000-12-14 WO disclosed
US-5484932-A Halogenation processes in advantageous solvents, and novel bistrifluoromethyl-polyfluoroalkoxybenzenes BAYER AKTIENGESELLSCHAFT (DE) 1996-01-16 US disclosed
US-5440051-A Halogenating by metering into reaction vessel at the same time as chlorine in presence of solvent or absence of solvent to form a chemical intermediates for fungicides or insecticides BAYER AKTIENGESELLSCHAFT (DE) 1995-08-08 US disclosed
JP-H06263678-A CHLORODIFLUOROMETHOXYPHENYL DERIVATIVE F HOFFMANN LA ROCHE AG 1994-09-20 JP 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-20120232265-A1 1,2-Disubstituted Heterocyclic Compounds PDE12, PDE7A, PDE10A ALDH1A1 699/4885LMNA 3565/4885MAPT 476/4885
US-20190055257-A1 SUBSTITUTED 6,7-DIHYDROPYRAZOLO[1,5-a]PYRAZINES AS NEGATIVE ALLOSTERIC MODULATORS OF MGLUR2 RECEPTORS GRM2, GRM5, GRM1 ALDH1A1 4145/4885LMNA 4573/4885MAPT 1193/4885
US-10005786-B2 Substituted 6,7-dihydropyrazolo[1,5-a]pyrazines as negative allosteric modulators of MGLUR2 receptors GRM2, GRM5, GRM1 ALDH1A1 3723/4885LMNA 4481/4885MAPT 1265/4885
US-20210032181-A1 DIFLUOROMETHOXYLATION AND TRIFLUOROMETHOXYLATION COMPOSITIONS AND METHODS FOR SYNTHESIZING SAME AFF2, AFF4, AFF1 ALDH1A1 1490/4885LMNA 2457/4885MAPT 2445/4885
US-20200121677-A1 SUBSTITUTED 6,7-DIHYDROPYRAZOLO[1,5-a]PYRAZINES AS NEGATIVE ALLOSTERIC MODULATORS OF MGLUR2 RECEPTORS GRM2, GRM5, GRM1 ALDH1A1 4145/4885LMNA 4573/4885MAPT 1193/4885
US-11760701-B2 Difluoromethoxylation and trifluoromethoxylation compositions and methods for synthesizing same AFF2, AFF4, AFF1 ALDH1A1 1490/4885LMNA 2457/4885MAPT 2445/4885
US-10005785-B2 Substituted 6,7-dihydropyrazolo[1,5-a] pyrazines as negative allosteric modulators of mGlUR2 receptors GRM2, GRM5, GRM1 ALDH1A1 3723/4885LMNA 4481/4885MAPT 1265/4885

“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.