SCHEMBL463544

SCHEMBL463544

CNc1cc(F)cc(F)c1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RAPGEF4 Q8WZA2 2/20 0.44
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA9 Q16790 1/20 0.38
TSHR P16473 1/20 0.36
IDO1 P14902 3/20 0.35
SOS1 Q07889 1/20 0.34
CES2 O00748 1/20 0.33
CES1 P23141 1/20 0.33
APP P05067 2/20 0.32
KIF11 P52732 1/20 0.31
EGFR P00533 1/20 0.31
HDAC3 O15379 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC2 Q92769 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31

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
SCHEMBL5506973 0.94 RAPGEF4 (0.39) RAPGEF4CA12CA1CA9TSHR
SCHEMBL16181574 0.84 RAPGEF4 (0.48) RAPGEF4EGFRHDAC3HDAC1HDAC2
SCHEMBL5514489 0.82 CA12 (0.55) RAPGEF4CA12CA1CA9APP
SCHEMBL5506948 0.82 HTR6 (0.36) RAPGEF4TSHR
SCHEMBL1638576 0.82 RAPGEF4 (0.53) RAPGEF4
SCHEMBL24594971 0.82 RAPGEF4 (0.33) RAPGEF4
SCHEMBL24807015 0.82 RAPGEF4 (0.33) RAPGEF4
SCHEMBL19089348 0.82 HTR6 (0.39) RAPGEF4
SCHEMBL29909475 0.82 HTR6 (0.39) RAPGEF4
SCHEMBL25005829 0.78 MEN1 (0.35) RAPGEF4KIF11EGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103360312-A Geldanamycin derivative and its application UNIV SHANDONG 2013-10-23 CN claimed
US-7943605-B2 Compounds comprising a lactam or a lactam derivative moiety, processes for making them, and their uses UCB PHARMA S.A. (BE) 2011-05-17 US claimed
US-20090023708-A1 Compounds Comprising a Lactam or a Lactam Derivative Moiety, Processes for Making Them, and Their Uses UCB PHARMA, S.A. (BE) 2009-01-22 US claimed
EP-1943217-A1 COMPOUNDS COMPRISING A LACTAM OR A LACTAM DERIVATIVE MOIETY, PROCESSES FOR MAKING THEM, AND THEIR USES UCB Pharma, S.A. (BE) 2008-07-16 EP claimed
WO-2007048595-A1 COMPOUNDS COMPRISING A LACTAM OR A LACTAM DERIVATIVE MOIETY, PROCESSES FOR MAKING THEM, AND THEIR USES UCB PHARMA, S.A. (BE) 2007-05-03 WO claimed
EP-3600294-B1 TRI-SUBSTITUTED IMIDAZOLES FOR THE INHIBITION OF TGF BETA AND METHODS OF TREATMENT CLAVIUS PHARMACEUTICALS LLC (US) 2025-09-03 EP disclosed
WO-2025107026-A1 TSPO LIGANDS THE UNIVERSITY OF SYDNEY (AU) 2025-05-30 WO disclosed
US-20240383885-A1 Compounds for Treating Cannabinoid Toxicity and Acute Cannabinoid Overdose MAKSCIENTIFIC, LLC 2024-11-21 US disclosed
US-12054480-B2 Compounds for treating cannabinoid toxicity and acute cannabinoid overdose MAKSCIENTIFIC, LLC (US) 2024-08-06 US disclosed
CN-117500795-A Receptor interacting protein 1 inhibitor, preparation and application thereof 维泰瑞隆有限公司 2024-02-02 CN disclosed
CN-117466803-A Compounds, salts thereof and methods for treating diseases 阿卡蒂亚药品公司 2024-01-30 CN disclosed
CN-117412952-A METAP-2 inhibitors, pharmaceutical compositions and methods of treatment thereof 康崴新药有限公司 2024-01-16 CN disclosed
EP-1633748-B1 QUINOLINE DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS GLAXO GROUP LTD (GB) 2008-03-05 EP disclosed
US-20070142373-A1 Quinoline derivatives as phosphodiesterase inhibitors GLAXO GROUP LIMITED (GB) 2007-06-21 US disclosed
US-20070142373-A1 Quinoline derivatives as phosphodiesterase inhibitors GLAXO GROUP LIMITED (GB) 2007-06-21 US disclosed
WO-2007048595-A1 COMPOUNDS COMPRISING A LACTAM OR A LACTAM DERIVATIVE MOIETY, PROCESSES FOR MAKING THEM, AND THEIR USES UCB PHARMA, S.A. (BE) 2007-05-03 WO disclosed
US-20070049570-A1 Quinoline derivatives as phosphodiesterase inhibitors DEAN ANTHONY W 2007-03-01 US disclosed
US-20070049570-A1 Quinoline derivatives as phosphodiesterase inhibitors DEAN ANTHONY W 2007-03-01 US disclosed
WO-2007025307-A2 INHIBITORS OF SERINE PROTEASES VERTEX PHARMACEUTICALS INCORPORATED (US) 2007-03-01 WO disclosed
WO-2004103998-A1 QUINOLINE DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS GLAXO GROUP LIMITED (GB) 2004-12-02 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 (5 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-20240383885-A1 Compounds for Treating Cannabinoid Toxicity and Acute Cannabinoid Overdose CNR1, CNR2, OPRM1 RAPGEF4 3455/4885CA12 3857/4885CA1 3370/4885
US-20090023708-A1 Compounds Comprising a Lactam or a Lactam Derivative Moiety, Processes for Making Them, and Their Uses COASY, FURIN, PEPD RAPGEF4 3259/4885CA12 1881/4885CA1 3317/4885
US-12054480-B2 Compounds for treating cannabinoid toxicity and acute cannabinoid overdose CNR1, CNR2, OPRM1 RAPGEF4 3455/4885CA12 3857/4885CA1 3370/4885
US-20070049570-A1 Quinoline derivatives as phosphodiesterase inhibitors PDE3B, PDE4B, PDE4A RAPGEF4 366/4885CA12 4618/4885CA1 4500/4885
US-20070142373-A1 Quinoline derivatives as phosphodiesterase inhibitors PDE3B, PDE4B, PDE4A RAPGEF4 366/4885CA12 4618/4885CA1 4500/4885

“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.