SCHEMBL17595010

SCHEMBL17595010

FC(F)(F)C1(c2ccnc(Cl)c2)CC1

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.35
LOX P28300 1/20 0.35
LOXL3 P58215 1/20 0.35
LOXL2 Q9Y4K0 1/20 0.35
SMARCA2 P51531 2/20 0.35
SMARCA4 P51532 2/20 0.35
KDM4C Q9H3R0 1/20 0.34
S1PR1 P21453 1/20 0.33
S1PR3 Q99500 1/20 0.33
TRPA1 O75762 1/20 0.33
SIGMAR1 Q99720 1/20 0.32
NOS3 P29474 1/20 0.32
NOS2 P35228 1/20 0.32
WDR5 P61964 1/20 0.32
AKR1C3 P42330 1/20 0.30
AKR1C2 P52895 1/20 0.30
IDO1 P14902 1/20 0.30
PDK2 Q15119 1/20 0.30

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
SCHEMBL31283794 1.00 RECQL (0.35) RECQLLOXLOXL3LOXL2SMARCA2
SCHEMBL27463527 0.79 NOS3 (0.52) KDM4CS1PR1S1PR3SIGMAR1NOS3
SCHEMBL27334465 0.76 RECQL (0.33) RECQLLOXLOXL3LOXL2S1PR1
SCHEMBL20264735 0.75 HDAC6 (0.40) KDM4C
SCHEMBL17594694 0.73 KDM4E (0.46) KDM4CWDR5
SCHEMBL25322547 0.73 TRPA1 (0.40) TRPA1SIGMAR1
SCHEMBL28165728 0.72 KDM4C (0.38) KDM4CTRPA1SIGMAR1
SCHEMBL31275701 0.72 RECQL (0.38) RECQLLOXLOXL3LOXL2SMARCA2
SCHEMBL15390633 0.72 RECQL (0.42) RECQLLOXLOXL3LOXL2SMARCA2
SCHEMBL29272414 0.71 RECQL (0.35) RECQLLOXLOXL3LOXL2SMARCA2

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4547657-A1 CD73 COMPOUNDS GILEAD SCIENCES, INC. (US) 2025-05-07 EP disclosed
US-20240116928-A1 CD73 COMPOUNDS GILEAD SCIENCES, INC. 2024-04-11 US disclosed
WO-2024006929-A1 CD73 COMPOUNDS GILEAD SCIENCES, INC. (US) 2024-01-04 WO disclosed
WO-2024006929-A1 CD73 COMPOUNDS GILEAD SCIENCES, INC. (US) 2024-01-04 WO disclosed
CN-107074828-B Compounds and compositions as RAF kinase inhibitors 诺华股份有限公司 2020-05-19 CN disclosed
EP-3191478-B1 COMPOUNDS AND COMPOSITIONS AS RAF KINASE INHIBITORS NOVARTIS AG (CH) 2019-05-08 EP disclosed
US-10167279-B2 Compounds and compositions as RAF kinase inhibitors NOVARTIS AG (CH) 2019-01-01 US disclosed
US-10167279-B2 Compounds and compositions as RAF kinase inhibitors NOVARTIS AG (CH) 2019-01-01 US disclosed
US-20180170917-A1 COMPOUNDS AND COMPOSITIONS AS RAF KINASE INHIBITORS NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2018-06-21 US disclosed
US-20180170917-A1 COMPOUNDS AND COMPOSITIONS AS RAF KINASE INHIBITORS NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2018-06-21 US disclosed
US-20180170917-A1 COMPOUNDS AND COMPOSITIONS AS RAF KINASE INHIBITORS NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2018-06-21 US disclosed
EP-3191478-A1 COMPOUNDS AND COMPOSITIONS AS RAF KINASE INHIBITORS Novartis AG (CH) 2017-07-19 EP disclosed
WO-2016038582-A1 COMPOUNDS AND COMPOSITIONS AS RAF KINASE INHIBITORS NOVARTIS AG (CH) 2016-03-17 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 (3 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-20180170917-A1 COMPOUNDS AND COMPOSITIONS AS RAF KINASE INHIBITORS BRAF, RAF1, ARAF RECQL 1468/4885LOX 2028/4885LOXL3 2757/4885
US-10167279-B2 Compounds and compositions as RAF kinase inhibitors BRAF, RAF1, ARAF RECQL 1468/4885LOX 2028/4885LOXL3 2757/4885
US-20240116928-A1 CD73 COMPOUNDS ENTPD5, NT5E, ENTPD1 RECQL 2126/4885LOX 1400/4885LOXL3 2397/4885

“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.