SCHEMBL23106904

SCHEMBL23106904

Cc1cnc2n1CC[C@H](C)C2

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAP4K1 Q92918 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 3/20 0.31
MAPT P10636 4/20 0.31
TP53 P04637 3/20 0.31
MEN1 O00255 1/20 0.30
PKM P14618 1/20 0.30
TSHR P16473 1/20 0.30
KMT2A Q03164 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
SCHEMBL23107347 1.00 MAP4K1 (0.32) MAP4K1ALDH1A1LMNAMAPTTP53
SCHEMBL23106882 1.00 MAP4K1 (0.32) MAP4K1ALDH1A1LMNAMAPTTP53
SCHEMBL23089487 0.80 ALDH1A1 (0.34) MAP4K1ALDH1A1LMNAKMT2A
SCHEMBL24493046 0.77 NOS3 (0.33)
SCHEMBL23103528 0.77 CPB2 (0.38) MAP4K1ALDH1A1LMNAMAPTTP53
SCHEMBL23114542 0.77 MAP4K1 (0.32) MAP4K1LMNAMAPTTP53MEN1
SCHEMBL23108875 0.77 LMNA (0.32) MAP4K1LMNAMAPTTP53
SCHEMBL23108633 0.77 LMNA (0.32) MAP4K1LMNAMAPTTP53
SCHEMBL23133738 0.77 CPB2 (0.38) MAP4K1ALDH1A1LMNAMAPTTP53
SCHEMBL24493449 0.76 PDE10A (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022174253-A1 HPK1 ANTAGONISTS AND USES THEREOF Nimbus Saturn, Inc. (US) 2022-08-18 WO disclosed
WO-2021050964-A1 HPK1 ANTAGONISTS AND USES THEREOF Nimbus Saturn, Inc. (US) 2021-03-18 WO disclosed