SCHEMBL23608014

SCHEMBL23608014

Cc1cnc(Nc2cc(CN3CCOCC3)cc(N[C@H]3CCCN(C(=O)OC(C)(C)C)C3)n2)s1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BTK Q06187 4/20 0.42
HCK P08631 2/20 0.42
MAP3K12 Q12852 1/20 0.41
TBK1 Q9UHD2 4/20 0.39
ITK Q08881 2/20 0.38
CNR2 P34972 1/20 0.38
USP30 Q70CQ3 2/20 0.37
KDR P35968 1/20 0.37
BRD4 O60885 1/20 0.36
IRAK1 P51617 1/20 0.36
HDAC4 P56524 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
MAPK1 P28482 1/20 0.36

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
SCHEMBL21792649 1.00 BTK (0.42) BTKHCKMAP3K12TBK1ITK
SCHEMBL29261762 0.91 BTK (0.41) BTKHCKTBK1ITKCNR2
SCHEMBL21792590 0.91 BTK (0.41) BTKHCKTBK1ITKCNR2
SCHEMBL28546348 0.89 MAP3K12 (0.46) BTKHCKMAP3K12ITKCNR2
SCHEMBL28554401 0.89 MAP3K12 (0.46) BTKHCKMAP3K12ITKCNR2
SCHEMBL21792687 0.88 KDR (0.39) MAP3K12TBK1ITKKDRIRAK1
SCHEMBL29261761 0.88 BTK (0.42) BTKHCKMAP3K12ITKCNR2
SCHEMBL21792591 0.88 BTK (0.42) BTKHCKMAP3K12ITKCNR2
SCHEMBL29412176 0.88 BTK (0.42) BTKHCKMAP3K12ITKCNR2
SCHEMBL21777159 0.87 BTK (0.54) BTKHCKMAP3K12ITK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4643954-A2 NOVEL HETEROCYCLIC AMINE DERIVATIVE AND PHARMACEUTICAL COMPOSITION COMPRISING SAME Daewoong Pharmaceutical Co., Ltd. (KR) 2025-11-05 EP disclosed
US-20230094404-A1 METHOD FOR PREPARATION OF HETEROCYCLICAMINE DERIVATIVES DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 2023-03-30 US disclosed
US-20220064155-A1 NOVEL HETEROCYCLIC AMINE DERIVATIVE AND PHARMACEUTICAL COMPOSITION COMPRISING SAME DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 2022-03-03 US disclosed
EP-3845530-A1 NOVEL HETEROCYCLIC AMINE DERIVATIVE AND PHARMACEUTICAL COMPOSITION COMPRISING SAME Daewoong Pharmaceutical Co., Ltd. (KR) 2021-07-07 EP 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-20230094404-A1 METHOD FOR PREPARATION OF HETEROCYCLICAMINE DERIVATIVES HNMT, MAOB, PNMT BTK 3135/4885HCK 1397/4885MAP3K12 3047/4885
US-20220064155-A1 NOVEL HETEROCYCLIC AMINE DERIVATIVE AND PHARMACEUTICAL COMPOSITION COMPRISING SAME H1-5, H1-2, SSB BTK 133/4885HCK 3523/4885MAP3K12 3707/4885

“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.