SCHEMBL17594690

SCHEMBL17594690

O=C(O)c1ccnc(C2(C(F)(F)F)CC2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 7/20 0.49
KDM5C P41229 6/20 0.46
KDM4E B2RXH2 5/20 0.46
KDM2A Q9Y2K7 5/20 0.46
KDM3A Q9Y4C1 5/20 0.46
KDM6B O15054 4/20 0.46
KDM4A O75164 4/20 0.46
FTO Q9C0B1 3/20 0.46
KDM5B Q9UGL1 2/20 0.46
ALKBH5 Q6P6C2 2/20 0.46
TET3 O43151 1/20 0.46
BBOX1 O75936 1/20 0.46
ALDH1A1 P00352 1/20 0.46
MAPT P10636 1/20 0.46
KDM5A P29375 1/20 0.46
ASPH Q12797 1/20 0.46
KDM4D Q6B0I6 1/20 0.46
TET2 Q6N021 1/20 0.46
KDM7A Q6ZMT4 1/20 0.46
KDM8 Q8N371 1/20 0.46

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
SCHEMBL25985199 0.79 KDM4C (0.50) KDM4CKDM5CKDM4EKDM2AKDM3A
SCHEMBL31032217 0.79 KDM4C (0.50) KDM4CKDM5CKDM4EKDM2AKDM3A
SCHEMBL30701650 0.77 KCNJ6 (0.37) KDM4CKDM4EALDH1A1PIK3CAKCNJ6
SCHEMBL27357711 0.77 KCNJ6 (0.35) KDM4CPIK3CAKCNJ6KCNJ5KCNJ3
SCHEMBL30908333 0.76 P4HA1 (0.46) ALDH1A1MAPTGABRPGABRDGABRA1
SCHEMBL29990008 0.76 P4HA1 (0.46) ALDH1A1MAPTGABRPGABRDGABRA1
SCHEMBL31229393 0.74 KDM4C (0.49) KDM4CKDM5CKDM4EKDM2AKDM3A
SCHEMBL24462402 0.72 KDM4C (0.46) KDM4CKDM5CKDM4EKDM2AKDM3A
SCHEMBL16094931 0.72 KDM4C (0.46) KDM4CKDM5CKDM4EKDM2AKDM3A
SCHEMBL12310375 0.72 KDM4C (0.46) KDM4CKDM5CKDM4EKDM2AKDM3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
CN-107074828-A Compounds and compositions as raf kinase inhibitors 诺华股份有限公司 2017-08-18 CN 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 (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-20180170917-A1 COMPOUNDS AND COMPOSITIONS AS RAF KINASE INHIBITORS BRAF, RAF1, ARAF KDM4C 2617/4885KDM5C 2628/4885KDM4E 2165/4885
US-10167279-B2 Compounds and compositions as RAF kinase inhibitors BRAF, RAF1, ARAF KDM4C 2617/4885KDM5C 2628/4885KDM4E 2165/4885

“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.