SCHEMBL336320

SCHEMBL336320

O=Cc1ccc(C(F)(F)F)nc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 1/20 0.52
ALDH1A1 P00352 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
POLB P06746 1/20 0.45
TRPV1 Q8NER1 1/20 0.39
DAO P14920 3/20 0.39
KDM4E B2RXH2 2/20 0.39
KCNJ1 P48048 1/20 0.39
KIF11 P52732 1/20 0.37
CYP2C9 P11712 1/20 0.36
SLC22A6 Q4U2R8 1/20 0.36
SLC22A8 Q8TCC7 1/20 0.36
SLC22A12 Q96S37 1/20 0.36
SLC22A11 Q9NSA0 1/20 0.36
MRGPRX4 Q96LA9 1/20 0.36
KCNH2 Q12809 3/20 0.35
HDAC4 P56524 1/20 0.35
MAP4K4 O95819 1/20 0.35
PIK3CA P42336 1/20 0.35
MINK1 Q8N4C8 1/20 0.35

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
SCHEMBL29417132 1.00 TRPV4 (0.52) TRPV4ALDH1A1L3MBTL1POLBTRPV1
SCHEMBL9607467 0.88 DGAT1 (0.42) TRPV4ALDH1A1L3MBTL1POLBKCNH2
SCHEMBL18003021 0.85 KIF11 (0.47) TRPV4KIF11KCNH2MAP4K4PIK3CA
SCHEMBL932830 0.84 ALDH1A1 (0.40) TRPV4ALDH1A1L3MBTL1POLBKDM4E
SCHEMBL30798672 0.84 ALDH1A1 (0.40) TRPV4ALDH1A1L3MBTL1POLBKDM4E
SCHEMBL24400539 0.83 ALDH1A1 (0.62) TRPV4ALDH1A1L3MBTL1POLBKDM4E
SCHEMBL3851697 0.82 TRPV4 (0.50) TRPV4TRPV1DAOKCNH2MAP4K4
SCHEMBL18499517 0.81 ALDH1A1 (0.38) TRPV4ALDH1A1L3MBTL1POLBTRPV1
SCHEMBL23727328 0.81 ALDH1A1 (0.38) TRPV4ALDH1A1L3MBTL1POLBKDM4E
SCHEMBL6227922 0.81 TRPV4 (0.46) TRPV4ALDH1A1L3MBTL1POLBTRPV1

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 1088 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3356387-B1 ANTIMICROBIAL POLYMYXIN DERIVATIVE COMPOUNDS UNIV MONASH (AU) 2024-06-26 EP claimed
CN-113336821-B Glycyrrhetinic acid derivative Z-type isomer and preparation method thereof 五邑大学 2023-05-23 CN claimed
CN-114736204-A Preparation method of pexidaltinib structural analogue and application of pexidaltinib structural analogue in tumor resistance 湖北工业大学 2022-07-12 CN claimed
US-11225505-B2 Antimicrobial polymyxin derivative compounds MONASH UNIVERSITY (AU) 2022-01-18 US claimed
CN-112175036-B Glycyrrhetinic acid derivative and preparation method and application thereof 五邑大学 2021-11-16 CN claimed
CN-113336821-A Glycyrrhetinic acid derivative Z-type isomer and preparation method thereof 五邑大学 2021-09-03 CN claimed
CN-112175036-A Glycyrrhetinic acid derivative and preparation method and application thereof 五邑大学 2021-01-05 CN claimed
US-20180282374-A1 ANTIMICROBIAL POLYMYXIN DERIVATIVE COMPOUNDS MONASH UNIVERSITY (AU) 2018-10-04 US claimed
EP-3356387-A1 ANTIMICROBIAL POLYMYXIN DERIVATIVE COMPOUNDS Monash University (AU) 2018-08-08 EP claimed
CN-101845091-A Metastin derivative and use thereof TAKEDA PHARMACEUTICAL 2010-09-29 CN claimed
US-20070043076-A1 Substituted 2-arylmethylene-n-aryl-n'aryl-malonamides and analogs as activators of caspases and inducers of apoptosis CYTOVIA, INC. 2007-02-22 US claimed
WO-2005037196-A2 SUBSTITUTED 2-ARYLMETHYLENE-N-ARYL-N'-ARYL-MALONAMIDES AND ANALOGS AS ACTIVATORS OF CASPASES AND INDUCERS OF APOPTOSIS CYTOVIA, INC. (US) 2005-04-28 WO claimed
US-12577208-B2 TEAD inhibitors and uses thereof EHE Foundation (US) 2026-03-17 US disclosed
US-20260001870-A1 INHIBITOR COMPOUNDS Cincera Therapeutics Pty Ltd (AU) 2026-01-01 US disclosed
US-12509439-B2 Anti-malarial agents UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION (US) 2025-12-30 US disclosed
US-20250368625-A1 PIPERAZINES Grünenthal GmbH (DE) 2025-12-04 US disclosed
US-20040018994-A1 3-Descladinosyl-6-O-carbamoyl and 6-O-carbonoyl macrolide antibacterial agents JANSSEN PHARMACEUTICA N.V. (BE) 2004-01-29 US disclosed
WO-2003102010-A1 3-DESCLADINOSYL-6-O-CARBAMOYL AND 6-O-CARBONOYL MACROLIDE ANTIBACTERIAL AGENTS JANSSEN PHARMACEUTICA N.V. (BE) 2003-12-11 WO 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-2003064376-A1 SUBSTITUTED METHYLENE AMIDE DERIVATIVES AS MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPS) APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2003-08-07 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 (8 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-11225505-B2 Antimicrobial polymyxin derivative compounds VIP, PNKP, PEPD TRPV4 2270/4885ALDH1A1 4859/4885L3MBTL1 1643/4885
US-12509439-B2 Anti-malarial agents RCC1, PFN1, NHERF1 TRPV4 1975/4885ALDH1A1 1353/4885L3MBTL1 3793/4885
US-20070043076-A1 Substituted 2-arylmethylene-n-aryl-n'aryl-malonamides and analogs as activators of caspases and inducers of apoptosis CASP14, CASP2, CASP3 TRPV4 3654/4885ALDH1A1 952/4885L3MBTL1 280/4885
US-20040018994-A1 3-Descladinosyl-6-O-carbamoyl and 6-O-carbonoyl macrolide antibacterial agents CHCHD6, MRPL21, MRPS18B TRPV4 4615/4885ALDH1A1 4053/4885L3MBTL1 1042/4885
US-20260001870-A1 INHIBITOR COMPOUNDS CES1, NCEH1, NR1H2 TRPV4 4318/4885ALDH1A1 778/4885L3MBTL1 1210/4885
US-20180282374-A1 ANTIMICROBIAL POLYMYXIN DERIVATIVE COMPOUNDS VIP, PNKP, PEPD TRPV4 2270/4885ALDH1A1 4859/4885L3MBTL1 1643/4885
US-12577208-B2 TEAD inhibitors and uses thereof BRCA1, BRAF, MEN1 TRPV4 3064/4885ALDH1A1 618/4885L3MBTL1 1956/4885
US-20250368625-A1 PIPERAZINES SSTR4, SSTR5, SSTR2 TRPV4 35/4885ALDH1A1 2067/4885L3MBTL1 4881/4885

“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.