SCHEMBL17181924

SCHEMBL17181924

CCN1CCN(Cc2ccc(NC(=O)c3cncc(Br)c3)cc2C(F)(F)F)CC1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EPHA2 P29317 3/20 0.66
▸ BTK Q06187 5/20 0.64
▸ HCK P08631 3/20 0.64
▸ KMT2A Q03164 3/20 0.63
▸ KDM4E B2RXH2 2/20 0.63
▸ MAPT P10636 2/20 0.63
▸ UBE2N P61088 1/20 0.63
▸ TDP1 Q9NUW8 1/20 0.63
▸ NR2C2 P49116 3/20 0.61
▸ RET P07949 1/20 0.61
▸ GCK P35557 1/20 0.60
▸ PAX8 Q06710 1/20 0.59
▸ EGFR P00533 1/20 0.59
▸ BRAF P15056 1/20 0.59
▸ HTT P42858 2/20 0.58
▸ MEN1 O00255 1/20 0.58
▸ L3MBTL1 Q9Y468 1/20 0.58
▸ MAPK1 P28482 1/20 0.57
▸ ATM Q13315 1/20 0.57
▸ FGFR1 P11362 1/20 0.57

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
SCHEMBL15688235 0.86 MKNK2 (0.67) EPHA2BTKHCKKMT2AKDM4E
SCHEMBL15690013 0.85 MAPT (0.58) EPHA2HCKKMT2AKDM4EMAPT
SCHEMBL28054362 0.83 HTT (0.65) HCKKMT2AKDM4EMAPTNR2C2
SCHEMBL20568827 0.80 EPHA2 (0.63) EPHA2KMT2AKDM4EMAPTRET
SCHEMBL1420613 0.80 CHRM4 (0.67) EPHA2KMT2AMAPTRETPAX8
SCHEMBL27088109 0.80 RET (0.64) EPHA2HCKRETEGFRBRAF
SCHEMBL17208644 0.80 RET (0.64) EPHA2HCKRETEGFRBRAF
SCHEMBL14704589 0.80 MKNK2 (0.65) EPHA2HCKRETEGFRBRAF
SCHEMBL26215023 0.80 EGFR (0.64) EPHA2KMT2AKDM4EMAPTUBE2N
SCHEMBL24098536 0.80 RET (0.76) RETEGFRBRAFFGFR1KDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2917214-B1 SUBSTITUTED PYRIMIDINYL AND PYRIDINYL-PYRROLOPYRIDINONES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES SRL (IT) 2019-08-28 — — EP disclosed
US-9604980-B2 Substituted pyrimidinyl and pyridinyl-pyrrolopyridinones, process for their preparation and their use as kinase inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2017-03-28 — — US disclosed
US-20150299192-A1 SUBSTITUTED PYRIMIDINYL AND PYRIDINYL-PYRROLOPYRIDINONES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2015-10-22 — — US 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 (1 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-20150299192-A1 SUBSTITUTED PYRIMIDINYL AND PYRIDINYL-PYRROLOPYRIDINONES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS KINASE INHIBITORS RET, MAP3K8, MAP3K1 EPHA2 902/4885BTK 283/4885HCK 465/4885

“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.

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