SCHEMBL23940248

SCHEMBL23940248

CN(C)C(=O)c1nn(C(C)(C)C)c2ccccc12

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.41
SRC P12931 1/20 0.41
ELANE P08246 12/20 0.39
KDM4E B2RXH2 1/20 0.38
F2 P00734 4/20 0.37
PLAU P00749 4/20 0.37
CNR2 P34972 2/20 0.36
CNR1 P21554 1/20 0.36
POLB P06746 1/20 0.35
MEN1 O00255 1/20 0.35
PGR P06401 1/20 0.35
KMT2A Q03164 1/20 0.35
PDE4A P27815 1/20 0.34
PDE4B Q07343 1/20 0.34
PDE4C Q08493 1/20 0.34
PDE4D Q08499 1/20 0.34

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
SCHEMBL23940247 0.80 KDM4E (0.57) EGFRSRCELANEKDM4EF2
SCHEMBL23940253 0.73 KDM4E (0.42) ELANEKDM4EF2PLAUCNR2
SCHEMBL23940218 0.72 ATM (0.58) KDM4EMEN1KMT2A
SCHEMBL26564649 0.72 PDE4A (0.37) ELANEKDM4ECNR2POLBMEN1
SCHEMBL12575030 0.70 GLS (0.47) ELANEKDM4ECNR2POLBPDE4A
SCHEMBL14584166 0.69 RORC (0.55)
SCHEMBL4420492 0.68 PRKD3 (0.43) SRCKDM4ECNR2PDE4APDE4B
SCHEMBL14584040 0.68 PDE4A (0.37) SRCKDM4ECNR2POLBMEN1
SCHEMBL27249849 0.68 KDM4E (0.48) KDM4E
SCHEMBL31560837 0.67 ELANE (0.46) ELANEKDM4EMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210323966-A1 IMIDAZOPYRIDAZINE COMPOUNDS BRISTOL-MYERS SQUIBB COMPANY (US) 2021-10-21 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-20210323966-A1 IMIDAZOPYRIDAZINE COMPOUNDS TYK2, JAK3, JAK1 EGFR 2340/4885SRC 369/4885ELANE 3295/4885

“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.