SCHEMBL413572

SCHEMBL413572

O=C(O)c1cccnc1C(F)(F)F

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAPRT Q6XQN6 2/20 0.58
KDM4E B2RXH2 3/20 0.57
TDP1 Q9NUW8 2/20 0.57
ALDH1A1 P00352 4/20 0.55
CYP3A4 P08684 2/20 0.55
L3MBTL1 Q9Y468 2/20 0.55
ALOX15 P16050 2/20 0.55
MAPT P10636 1/20 0.55
TSHR P16473 1/20 0.55
BLM P54132 1/20 0.55
AGER Q15109 1/20 0.55
NPSR1 Q6W5P4 1/20 0.55
LMNA P02545 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
DHODH Q02127 6/20 0.49
HDAC6 Q9UBN7 2/20 0.49
MEN1 O00255 1/20 0.49
GMNN O75496 1/20 0.49
TTR P02766 1/20 0.49
CYP1A2 P05177 1/20 0.49

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
SCHEMBL29488337 1.00 NAPRT (0.58) NAPRTKDM4ETDP1ALDH1A1CYP3A4
SCHEMBL27764496 0.86 HDAC6 (0.50) NAPRTKDM4ETDP1ALDH1A1CYP3A4
SCHEMBL3934370 0.85 NAPRT (0.55) NAPRTKDM4ETDP1ALDH1A1CYP3A4
SCHEMBL8686505 0.84 LMNA (0.46) NAPRTKDM4ETDP1ALDH1A1CYP3A4
SCHEMBL30477668 0.83 HDAC6 (0.48) NAPRTKDM4ETDP1ALDH1A1CYP3A4
SCHEMBL2148942 0.83 HDAC6 (0.48) NAPRTKDM4ETDP1ALDH1A1CYP3A4
SCHEMBL18033657 0.83 HDAC6 (0.48) NAPRTKDM4ETDP1ALDH1A1CYP3A4
SCHEMBL628397 0.83 PARP1 (0.51) NAPRTKDM4ETDP1ALDH1A1CYP3A4
SCHEMBL29687007 0.83 PARP1 (0.51) NAPRTKDM4ETDP1ALDH1A1CYP3A4
SCHEMBL29058517 0.83 SMN1; SMN2 (0.53) NAPRTKDM4ETDP1ALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117447446-A Pyridine bisamide derivative, and preparation method and application thereof 山东京博农化科技股份有限公司 2024-01-26 CN claimed
EP-4232028-A1 METHODS OF MAKING NICOTINIC ACID DERIVATIVES Vertellus Holdings LLC (US) 2023-08-30 EP claimed
CN-116635369-A Process for preparing nicotinic acid derivatives 弗特鲁斯控股有限责任公司 2023-08-22 CN claimed
CN-111511731-B Olefin compounds as modulators of the farnesol X receptor 百时美施贵宝公司 2023-05-23 CN claimed
WO-2022087373-A1 METHODS OF MAKING NICOTINIC ACID DERIVATIVES VERTELLUS HOLDINGS LLC (US) 2022-04-28 WO claimed
CN-108623518-A Amides compound containing trifluoromethyl pyridine and the preparation method and application thereof 上海凯爱网络科技有限公司 2018-10-09 CN claimed
CN-102977009-B A kind of synthetic method of 2-trifluoromethyl-3-fluorine pyridine Ao Sainuo bio tech ltd, Hangzhou (CN) 2015-07-29 CN claimed
EP-2041111-A1 NEW PYRIDINE ANALOGUES AstraZeneca AB (SE) 2009-04-01 EP claimed
WO-2008002247-A1 NEW PYRIDINE ANALOGUES ASTRAZENECA AB (SE) 2008-01-03 WO claimed
WO-1999041237-A1 SUBSTITUTED PYRIDINES USEFUL FOR INHIBITING CHOLESTERYL ESTER TRANSFER PROTEIN ACTIVITY G.D. SEARLE & CO. (US) 1999-08-19 WO claimed
JP-3081263-A None JP disclosed
CN-122071460-A Amide compound with sterilization and insecticidal effects and application thereof 帕潘纳(北京)科技有限公司 2026-05-22 CN disclosed
CN-122010831-A Preparation method of 4-trifluoromethyl nicotinic acid 衢州凯沃化工有限公司 2026-05-12 CN disclosed
US-20260055094-A1 FXR (NR1H4) MODULATING COMPOUNDS GILEAD SCIENCES INC (US) 2026-02-26 US disclosed
US-12543674-B2 Embryogenesis factors for cellular reprogramming of a plant cell PIONEER HI-BRED INTERNATIONAL, INC. (US) 2026-02-10 US disclosed
EP-0258201-A1 5-Sulfur substituted pyridine monocarboxylic herbicides Monsanto Company (US) 1988-03-02 EP disclosed
CN-87103510-A Substituted pyridine herbicide 1988-01-20 CN disclosed
US-4692184-A HERBICIDES MONSANTO COMPANY (US) 1987-09-08 US disclosed
US-4655816-A PLANT GROWTH REGULATORS MONSANTO COMPANY (US) 1987-04-07 US disclosed
EP-0181852-A1 Substituted 2,6-substituted pyridine compounds Monsanto Company (US) 1986-05-21 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 (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-12543674-B2 Embryogenesis factors for cellular reprogramming of a plant cell CCNB2, CCNB1, CCNB3 NAPRT 2278/4885KDM4E 3773/4885TDP1 3165/4885
US-20260055094-A1 FXR (NR1H4) MODULATING COMPOUNDS NR1H4, NR1H2, NR1H3 NAPRT 2751/4885KDM4E 3958/4885TDP1 4672/4885

“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.