SCHEMBL31334659

SCHEMBL31334659

Clc1cnc(NC2CCCNC2)nc1-c1cccc(-c2ccccc2)c1

nearest known ligand 0.63

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CCNT1 O60563 19/20 0.63
CDK9 P50750 19/20 0.63
CCNK O75909 16/20 0.63
CDK12 Q9NYV4 16/20 0.63
CCNE1 P24864 15/20 0.63
CDK2 P24941 15/20 0.63
CDK7 P50613 13/20 0.63
CCNH P51946 12/20 0.63
CRBN Q96SW2 1/20 0.63
MNAT1 P51948 11/20 0.61
ADORA1 P30542 1/20 0.52

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
SCHEMBL31333450 1.00 CCNT1 (0.63) CCNT1CDK9CCNKCDK12CCNE1
SCHEMBL31333564 1.00 CCNT1 (0.63) CCNT1CDK9CCNKCDK12CCNE1
SCHEMBL31333514 0.92 CCNT1 (0.62) CCNT1CDK9CCNKCDK12CCNE1
SCHEMBL31334428 0.86 ADORA1 (0.53) CCNT1CDK9CCNKCDK12CCNE1
SCHEMBL31333658 0.86 ADORA1 (0.53) CCNT1CDK9CCNKCDK12CCNE1
SCHEMBL31334488 0.81 CCNK (0.64) CCNT1CDK9CCNKCDK12CCNE1
SCHEMBL31334197 0.80 ADORA1 (0.52) CCNT1CDK9CCNKCDK12CCNE1
SCHEMBL31334093 0.80 CCNT1 (0.53) CCNT1CDK9CDK7CCNHADORA1
SCHEMBL31334729 0.80 CCNT1 (0.53) CCNT1CDK9CDK7CCNHADORA1
SCHEMBL31334905 0.80 CCNT1 (0.53) CCNT1CDK9CDK7CCNHADORA1

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