SCHEMBL3633773

SCHEMBL3633773

NC(=O)c1ccc(C(F)(F)F)nc1O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.40
PARP1 P09874 4/20 0.40
JAK2 O60674 1/20 0.39
LMNA P02545 1/20 0.38
GAA P10253 1/20 0.37
TUBB4A P04350 1/20 0.36
TUBB P07437 1/20 0.36
TUBA3C P0DPH7 1/20 0.36
TUBA1B P68363 1/20 0.36
TUBA4A P68366 1/20 0.36
TUBB4B P68371 1/20 0.36
TUBB3 Q13509 1/20 0.36
TUBB2A Q13885 1/20 0.36
TUBB8 Q3ZCM7 1/20 0.36
TUBA3E Q6PEY2 1/20 0.36
TUBA1A Q71U36 1/20 0.36
TUBA1C Q9BQE3 1/20 0.36
TUBB6 Q9BUF5 1/20 0.36
TUBB2B Q9BVA1 1/20 0.36
TUBB1 Q9H4B7 1/20 0.36

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
SCHEMBL3632864 0.86 CASP1 (0.36) PARP1LMNAKMT2AKDM4EALDH1A1
SCHEMBL4480620 0.85 TAS2R14 (0.46) P2RX7LMNAGAATUBB4ATUBB
SCHEMBL4191868 0.81 IKBKB (0.42) P2RX7PARP1JAK2LMNAGAA
SCHEMBL3453722 0.80 CASP1 (0.43) P2RX7PARP1JAK2LMNAGAA
SCHEMBL30489817 0.80 CASP1 (0.43) P2RX7PARP1JAK2LMNAGAA
SCHEMBL3550940 0.80 LMNA (0.54) P2RX7LMNAGAANPC1RAB9A
SCHEMBL30572236 0.80 LMNA (0.54) P2RX7LMNAGAANPC1RAB9A
SCHEMBL15547246 0.77 TUBB4A (0.42) P2RX7LMNAGAATUBB4ATUBB
SCHEMBL9264129 0.77 TUBB4A (0.54) LMNAGAATUBB4ATUBBTUBA3C
SCHEMBL12775473 0.77 LMNA (0.42) P2RX7PARP1JAK2LMNAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101959863-B Process for production of 3-amino-2-chloro-6- trifluoromethylpyridine ISHIHARA SANGYO KAISHA 2014-01-08 CN claimed
CN-101959863-A Process for production of 3-amino-2-chloro-6- trifluoromethylpyridine ISHIHARA SANGYO KAISHA 2011-01-26 CN claimed
EP-2251329-A1 PROCESS FOR PRODUCTION OF 3-AMINO-2-CHLORO-6- TRIFLUOROMETHYLPYRIDINE ISHIHARA SANGYO KAISHA, LTD. (JP) 2010-11-17 EP claimed
WO-2020245088-A1 ADJUVANT COMBINATIONS AS FOLIAR UPTAKE ACCELERATORS FOR HERBICIDAL COMPOSITIONS BAYER AKTIENGESELLSCHAFT (DE) 2020-12-10 WO disclosed
CN-101959863-B Process for production of 3-amino-2-chloro-6- trifluoromethylpyridine ISHIHARA SANGYO KAISHA 2014-01-08 CN disclosed
CN-101959863-B Process for production of 3-amino-2-chloro-6- trifluoromethylpyridine ISHIHARA SANGYO KAISHA 2014-01-08 CN disclosed
US-8293900-B2 Acylated spiropiperidine derivatives as melanocortin-4 receptor modulators MERCK SHARP & DOHME CORP (US) 2012-10-23 US disclosed
US-8293900-B2 Acylated spiropiperidine derivatives as melanocortin-4 receptor modulators MERCK SHARP & DOHME CORP (US) 2012-10-23 US disclosed
CN-101959863-A Process for production of 3-amino-2-chloro-6- trifluoromethylpyridine ISHIHARA SANGYO KAISHA 2011-01-26 CN disclosed
CN-101959863-A Process for production of 3-amino-2-chloro-6- trifluoromethylpyridine ISHIHARA SANGYO KAISHA 2011-01-26 CN disclosed
EP-2251329-A1 PROCESS FOR PRODUCTION OF 3-AMINO-2-CHLORO-6- TRIFLUOROMETHYLPYRIDINE ISHIHARA SANGYO KAISHA, LTD. (JP) 2010-11-17 EP disclosed
EP-1987718-A1 Utilisation of pyridine-2-oxy-3-carbon amides as safener Bayer CropScience AG (DE) 2008-11-05 EP disclosed
EP-1987718-A1 Utilisation of pyridine-2-oxy-3-carbon amides as safener Bayer CropScience AG (DE) 2008-11-05 EP disclosed
EP-1987718-A1 Utilisation of pyridine-2-oxy-3-carbon amides as safener Bayer CropScience AG (DE) 2008-11-05 EP disclosed
US-20080269052-A1 USE of PYRIDINE-2-OXY-3-CARBOXAMIDES AS SAFENERS BAYER CROPSCIENCE AG (DE) 2008-10-30 US disclosed
US-20080269052-A1 USE of PYRIDINE-2-OXY-3-CARBOXAMIDES AS SAFENERS BAYER CROPSCIENCE AG (DE) 2008-10-30 US disclosed
US-20080269052-A1 USE of PYRIDINE-2-OXY-3-CARBOXAMIDES AS SAFENERS BAYER CROPSCIENCE AG (DE) 2008-10-30 US disclosed
US-20070265164-A1 Active Substances for Increasing Pathogenic Defense in Plants and Methods for the Detection Thereof BAYER CROPSCIENCE GMBH (DE) 2007-11-15 US disclosed
US-20070265164-A1 Active Substances for Increasing Pathogenic Defense in Plants and Methods for the Detection Thereof BAYER CROPSCIENCE GMBH (DE) 2007-11-15 US disclosed
WO-2007041052-A2 ACYLATED SPIROPIPERIDINE DERIVATIVES AS MELANOCORTIN-4 RECEPTOR MODULATORS MERCK & CO., INC. (US) 2007-04-12 WO 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 (2 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-20080269052-A1 USE of PYRIDINE-2-OXY-3-CARBOXAMIDES AS SAFENERS CBR3, CBR1, CYP4Z1 P2RX7 1542/4885PARP1 1761/4885JAK2 3734/4885
US-20070265164-A1 Active Substances for Increasing Pathogenic Defense in Plants and Methods for the Detection Thereof ME1, GUSB, CHI3L1 P2RX7 3822/4885PARP1 3808/4885JAK2 3727/4885

“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.