SCHEMBL2550872

SCHEMBL2550872

NCc1ccc(C(F)(F)F)cn1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.52
DAO P14920 1/20 0.45
MAOB P27338 2/20 0.43
KDM1A O60341 1/20 0.43
MAOA P21397 1/20 0.43
MBOAT4 Q96T53 1/20 0.42
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
TAAR1 Q96RJ0 1/20 0.41
PTGS1 P23219 1/20 0.38
HPGD P15428 1/20 0.38
PDE2A O00408 1/20 0.37
TEAD1 P28347 1/20 0.37
KIF11 P52732 1/20 0.37
ALDH1A1 P00352 1/20 0.37
RECQL P46063 1/20 0.37
NOTUM Q6P988 1/20 0.37
DPP4 P27487 1/20 0.36
MAPK1 P28482 1/20 0.36
LOXL2 Q9Y4K0 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
SCHEMBL29408885 1.00 KMT2A (0.52) KMT2ADAOMAOBKDM1AMAOA
Hydrochloric Acid SCHEMBL3902582 0.98 KMT2A (0.50) KMT2ADAOMAOBKDM1AMAOA
Hydrochloric Acid SCHEMBL23572864 0.98 KMT2A (0.50) KMT2ADAOMAOBKDM1AMAOA
Sulfuric Acid SCHEMBL28396016 0.89 KMT2A (0.51) KMT2ADAOMAOBKDM1AMAOA
Acetic Acid SCHEMBL28400640 0.88 KMT2A (0.54) KMT2ADAOMAOBKDM1AMAOA
SCHEMBL264652 0.84 TAAR1 (0.52) KMT2ADAOMAOBKDM1AMAOA
SCHEMBL31477886 0.84 TAAR1 (0.52) KMT2ADAOMAOBKDM1AMAOA
SCHEMBL11951542 0.83 KMT2A (0.50) KMT2ADAOMAOBKDM1AMAOA
Hydrochloric Acid SCHEMBL2130617 0.82 TAAR1 (0.50) KMT2ADAOMAOBKDM1AMAOA
SCHEMBL485439 0.79 KMT2A (0.47) KMT2ADAOMAOBKDM1AMAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117777008-A Preparation method of 2-aminomethyl-5-trifluoromethyl pyridine 天津均凯农业科技有限公司 2024-03-29 CN claimed
CN-111170932-A Preparation method of 2-aminomethyl-5-trifluoromethyl pyridine salt 大连九信精细化工有限公司 2020-05-19 CN claimed
US-20110312935-A1 1H-Benz Imidazole-5-Carboxamides As Anti-Inflammatory Agents BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-12-22 US claimed
WO-2010034796-A1 1H-BENZ IMIDAZOLE-5-CARBOXAMIDES AS ANTI-INFLAMMATORY AGENTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-04-01 WO claimed
JP-7025853-A None JP disclosed
US-20250376473-A1 PRMTS INHIBITOR AND USE THEREOF CYTOSINLAB THERAPEUTICS CO LTD (CN) 2025-12-11 US disclosed
US-20250145594-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ABBVIE INC. 2025-05-08 US disclosed
US-12281101-B2 Bicyclic lactams and methods of use thereof GENENTECH, INC. (US) 2025-04-22 US disclosed
WO-2025068985-A1 1-(1-OXO-1,2-DIHYDROPHTHALAZIN-6-YL)CYCLOALKYL-1-CARBOXAMIDE DERIVATIVES AS MTA-COOPERATIVE INHIBITORS OF PRMT5 BEIGENE SWITZERLAND GMBH (CH) 2025-04-03 WO disclosed
WO-2025039979-A1 PROTEIN ARGININE METHYLTRANSFERASE-5 INHIBITOR AND PHARMACEUTICAL USE THEREOF 江苏亚虹医药科技股份有限公司 2025-02-27 WO disclosed
EP-3604305-B1 NOVEL PYRIDONE CARBOXYLIC ACID DERIVATIVE OR SALT THEREOF WAKUNAGA PHARMA CO LTD (JP) 2024-08-28 EP disclosed
CN-118359617-A Protein arginine methyltransferase inhibitors 华润医药研究院(深圳)有限公司 2024-07-19 CN disclosed
WO-2003080578-A1 HETEROAROMATIC UREA DERIVATIVES AS VR-1 RECEPTOR MODULATORS FOR TREATING PAIN MERCK SHARP & DOHME LIMITED (GB) 2003-10-02 WO disclosed
WO-2003070247-A1 FUSED AZABICYCLIC COMPOUNDS THAT INHIBIT VANILLOID RECEPTOR SUBTYPE 1 (VR1) RECEPTOR ABBOTT LABORATORIES (US) 2003-08-28 WO disclosed
US-20030158198-A1 Fused azabicyclic compounds that inhibit vanilloid receptor subtype 1 (VR1) receptor ABBVIE INC. 2003-08-21 US disclosed
US-6586441-B2 2-Amino-6-benzylsulfanyl-4-thiophen-2-yl-pyridine-3,5-dicarbo -nitrile as an examplary preferred compound; Alzheimer's and Parkinson's diseases; neuroprotectors; schizophrenia, analgesics; anxiolytic agents; respiratory disorders HOFFMAN-LA ROCHE INC. 2003-07-01 US disclosed
EP-1261327-A2 ADENOSINE RECEPTOR MODULATORS F.HOFFMANN-LA ROCHE AG (CH) 2002-12-04 EP disclosed
US-20010027196-A1 Adenosine receptor ligands and their use in the treatment of disease F. HOFFMANN-LA ROCHE AG (CH) 2001-10-04 US disclosed
WO-2001062233-A2 ADENOSINE RECEPTOR MODULATORS F. HOFFMANN LA ROCHE AG (CH) 2001-08-30 WO disclosed
JP-H0725853-A AMIDO COMPOUND OR ITS SALT, ITS PRODUCTION AND CONTROLLER FOR HARMFUL ANIMAL CONTAINING THE SAME ISHIHARA SANGYO KAISHA LTD 1995-01-27 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 (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-20030158198-A1 Fused azabicyclic compounds that inhibit vanilloid receptor subtype 1 (VR1) receptor TRPV1, VIPR1, TMEM109 KMT2A 2802/4885DAO 2997/4885MAOB 1110/4885
US-20110312935-A1 1H-Benz Imidazole-5-Carboxamides As Anti-Inflammatory Agents MAPRE2, MAPRE1, H1-4 KMT2A 1047/4885DAO 4086/4885MAOB 2540/4885
US-20010027196-A1 Adenosine receptor ligands and their use in the treatment of disease ADORA2A, ADORA2B, ADORA1 KMT2A 2463/4885DAO 729/4885MAOB 157/4885
US-12281101-B2 Bicyclic lactams and methods of use thereof LSS, LPXN, CYP1B1 KMT2A 3390/4885DAO 1025/4885MAOB 189/4885
US-20250145594-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ATF4, ATF1, DDIT3 KMT2A 4179/4885DAO 4161/4885MAOB 1447/4885
US-20250376473-A1 PRMTS INHIBITOR AND USE THEREOF PRMT5, PRMT1, PRMT6 KMT2A 43/4885DAO 2651/4885MAOB 3038/4885

“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.