SCHEMBL958496

SCHEMBL958496

N=C(N)c1ccccc1C(F)(F)F

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.50
▸ GAA P10253 1/20 0.50
▸ CNR2 P34972 2/20 0.41
▸ PTGS1 P23219 1/20 0.41
▸ CTNNB1 P35222 2/20 0.41
▸ WNT3A P56704 2/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ GRIN2D O15399 3/20 0.41
▸ GRIN3B O60391 3/20 0.41
▸ GRIN1 Q05586 3/20 0.41
▸ GRIN2A Q12879 3/20 0.41
▸ GRIN2B Q13224 3/20 0.41
▸ GRIN2C Q14957 3/20 0.41
▸ GRIN3A Q8TCU5 3/20 0.41
▸ F2 P00734 1/20 0.39
▸ F10 P00742 1/20 0.39
▸ F12 P00748 1/20 0.39

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
SCHEMBL29712527 1.00 LMNA (0.50) LMNAGAACNR2PTGS1CTNNB1
Hydrochloric Acid SCHEMBL3065338 0.98 LMNA (0.48) LMNAGAACNR2PTGS1CTNNB1
Hydrochloric Acid SCHEMBL31138645 0.98 LMNA (0.48) LMNAGAACNR2PTGS1CTNNB1
Hydrochloric Acid SCHEMBL1259553 0.96 LMNA (0.47) LMNAGAACNR2PTGS1CTNNB1
SCHEMBL17558530 0.84 PARP1 (0.43) LMNAGAAALDH1A1TDP1GRIN2D
SCHEMBL6208835 0.82 LMNA (0.38) LMNAGAAPTGS1ALDH1A1POLB
Hydrochloric Acid SCHEMBL27788451 0.80 LMNA (0.37) LMNAGAAPTGS1ALDH1A1POLB
SCHEMBL6145627 0.78 LMNA (0.50) LMNAGAACNR2PTGS1CTNNB1
SCHEMBL118007 0.78 LMNA (0.60) LMNAGAACNR2PTGS1CTNNB1
SCHEMBL20476361 0.78 TDP1 (0.46) ALDH1A1TDP1GRIN2DGRIN3BGRIN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2146971-A1 NOVEL BENZAMIDINE DERIVATIVES USEFUL AS POTASSIUM CHANNEL MODULATORS NeuroSearch A/S (DK) 2010-01-27 — — EP claimed
WO-2008135591-A1 NOVEL BENZAMIDINE DERIVATIVES USEFUL AS POTASSIUM CHANNEL MODULATORS NEUROSEARCH A/S (DK) 2008-11-13 — — WO claimed
US-12617762-B2 Carboxy derivatives with antiinflamatory properties SITRYX THERAPEUTICS LIMITED (GB) 2026-05-05 — — US disclosed
US-12570638-B2 Fused imidazole derivatives as AHR antagonists SAIL BIOMEDICINES, INC. (US) 2026-03-10 — — US disclosed
US-20240150506-A1 CURING AGENTS FOR FLUOROELASTOMERS U.S. BANK TRUST COMPANY, NATIONAL ASSOCIATION, AS NOTES COLLATERAL AGENT 2024-05-09 — — US disclosed
CN-117529520-A Fluoroelastomer compositions containing curative 杜邦特种产品美国有限公司 2024-02-06 — — CN disclosed
EP-4305096-A1 FLUOROELASTOMERS COMPOSITION COMPRISING CURING AGENTS Dupont Specialty Products USA, LLC (US) 2024-01-17 — — EP disclosed
US-20230331705-A1 Fused Imidazole Derivatives as AHR Antagonists SENDA BIOSCIENCES, INC. 2023-10-19 — — US disclosed
US-20230331705-A1 Fused Imidazole Derivatives as AHR Antagonists SENDA BIOSCIENCES, INC. 2023-10-19 — — US disclosed
US-20230331705-A1 Fused Imidazole Derivatives as AHR Antagonists SENDA BIOSCIENCES, INC. 2023-10-19 — — US disclosed
US-20230219907-A1 CARBOXY DERIVATIVES WITH ANTIINFLAMATORY PROPERTIES SITRYX THERAPEUTICS LIMITED (GB) 2023-07-13 — — US disclosed
US-7041685-B2 Substituted 3-aryl-5-aryl-[1,2,4]-oxadiazoles and analogs as activators of caspases and inducers of apoptosis and the use thereof CYTOVIA, INC. (US) 2006-05-09 — — US disclosed
US-20050154012-A1 Substituted 3-aryl-5-aryl-[1,2,4]-oxadiazoles and analogs as activators of caspases and inducers of apoptosis and the use thereof CYTOVIA, INC. 2005-07-14 — — US disclosed
EP-1532145-A1 PYRAZOLE COMPOSITIONS USEFUL AS INHIBITORS OF GSK-3 Vertex Pharmaceuticals Incorporated (US) 2005-05-25 — — EP disclosed
EP-1406632-A2 SUBSTITUTED 3-ARYL-5-ARYL- 1,2,4]-OXADIAZOLES AND ANALOGS AS ACTIVATORS OF CASPASES AND INDUCERS OF APOPTOSIS AND THE USE THEREOF Cytovia, Inc. (US) 2004-04-14 — — EP disclosed
US-20040039007-A1 Compositions useful as inhibitors of GSK-3 VERTEX PHARMACEUTICALS INCORPORATED 2004-02-26 — — US disclosed
WO-2004013140-A1 PYRAZOLE COMPOSITIONS USEFUL AS INHIBITORS OF GSK-3 VERTEX PHARMACEUTICALS INCORPORATED (US) 2004-02-12 — — WO disclosed
US-20030045546-A1 Substituted 3-aryl-5-aryl-[1,2,4]-oxadiazoles and analogs as activators of caspases and inducers of apoptosis and the use thereof CYTOVIA, INC. 2003-03-06 — — US disclosed
WO-2002100826-A2 SUBSTITUTED 3-ARYL-5-ARYL-[1,2,4]-OXADIAZOLES AND ANALOGS CYTOVIA, INC. (US) 2002-12-19 — — WO disclosed
US-3867448-A Trifluoromethylphenyl-formamadines and acetamidines CIBA GEIGY AG 1975-02-18 — — US 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-20230219907-A1 CARBOXY DERIVATIVES WITH ANTIINFLAMATORY PROPERTIES CPA2, RO60, C5AR1 LMNA 3388/4885GAA 1592/4885CNR2 275/4885
US-20030045546-A1 Substituted 3-aryl-5-aryl-[1,2,4]-oxadiazoles and analogs as activators of caspases and inducers of apoptosis and the use thereof CASP3, CASP1, API5 LMNA 1419/4885GAA 3175/4885CNR2 2583/4885
US-20040039007-A1 Compositions useful as inhibitors of GSK-3 GSK3A, GSK3B, GSKIP LMNA 1062/4885GAA 1592/4885CNR2 4599/4885
US-12617762-B2 Carboxy derivatives with antiinflamatory properties CCR1, CBR1, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 LMNA 1950/4885GAA 3050/4885CNR2 71/4885
US-20230331705-A1 Fused Imidazole Derivatives as AHR Antagonists AHR, ARNT, AIPL1 LMNA 4539/4885GAA 3368/4885CNR2 342/4885
US-20050154012-A1 Substituted 3-aryl-5-aryl-[1,2,4]-oxadiazoles and analogs as activators of caspases and inducers of apoptosis and the use thereof CASP3, CASP1, CASP4 LMNA 1844/4885GAA 3337/4885CNR2 2936/4885
US-12570638-B2 Fused imidazole derivatives as AHR antagonists AHR, ARNT, AIPL1 LMNA 3352/4885GAA 4320/4885CNR2 410/4885

“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.

Send feedback