SCHEMBL31334093

SCHEMBL31334093

N[C@H]1CC[C@H](Nc2ncc(Cl)c(-c3cccc(-c4ccccc4)c3)n2)CC1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CCNT1 O60563 4/20 0.53
ADORA1 P30542 4/20 0.53
CDK7 P50613 9/20 0.51
CDK9 P50750 8/20 0.51
ADORA2A P29274 2/20 0.50
FLT3 P36888 1/20 0.50
MERTK Q12866 3/20 0.49
CSNK1A1 P48729 1/20 0.49
CSNK1D P48730 1/20 0.49
CSNK1E P49674 1/20 0.49
CCNH P51946 1/20 0.49
ADORA2B P29275 1/20 0.46
AXL P30530 1/20 0.45
TYRO3 Q06418 1/20 0.45
MAPK1 P28482 1/20 0.45

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
SCHEMBL31334905 1.00 CCNT1 (0.53) CCNT1ADORA1CDK7CDK9ADORA2A
SCHEMBL31334729 1.00 CCNT1 (0.53) CCNT1ADORA1CDK7CDK9ADORA2A
SCHEMBL31334056 0.91 CCNT1 (0.57) CCNT1ADORA1CDK7CDK9ADORA2A
SCHEMBL31333867 0.86 ADORA1 (0.52) CCNT1ADORA1CDK7CDK9ADORA2A
SCHEMBL31334650 0.86 ADORA1 (0.52) CCNT1ADORA1CDK7CDK9ADORA2A
SCHEMBL31334197 0.86 ADORA1 (0.52) CCNT1ADORA1CDK7CDK9ADORA2A
SCHEMBL31334046 0.86 CDK9 (0.50) CCNT1ADORA1CDK7CDK9ADORA2A
SCHEMBL31333658 0.86 ADORA1 (0.53) CCNT1ADORA1CDK7CDK9ADORA2A
SCHEMBL31333856 0.86 CDK9 (0.50) CCNT1ADORA1CDK7CDK9ADORA2A
SCHEMBL31334428 0.86 ADORA1 (0.53) CCNT1ADORA1CDK7CDK9ADORA2A

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
EP-4709720-A1 INHIBITORS AND DEGRADERS OF PIP4K PROTEIN Larkspur Biosciences, Inc. (US) 2026-03-18 EP disclosed
WO-2024233846-A1 INHIBITORS AND DEGRADERS OF PIP4K PROTEIN LARKSPUR BIOSCIENCES, INC. (US) 2024-11-14 WO disclosed