SCHEMBL31334573

SCHEMBL31334573

O=c1ccccn1-c1cccc(-c2nc(NC3CCNCC3)ncc2Cl)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 11/20 0.49
JAK2 O60674 1/20 0.45
BRD4 O60885 1/20 0.45
CCNT1 O60563 2/20 0.44
CDK7 P50613 2/20 0.44
CDK9 P50750 2/20 0.44
CCNH P51946 2/20 0.44
MNAT1 P51948 2/20 0.44
CDK2 P24941 3/20 0.44
CCNK O75909 1/20 0.44
CCNE1 P24864 1/20 0.44
CDK12 Q9NYV4 1/20 0.44
MAPK8 P45983 2/20 0.43
SYK P43405 1/20 0.43
ADORA1 P30542 1/20 0.42
CCNA2 P20248 1/20 0.41
MAPK3 P27361 1/20 0.41
PCSK9 Q8NBP7 2/20 0.41
JUN P05412 1/20 0.41
MAPK9 P45984 1/20 0.41

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
SCHEMBL31333644 0.89 JAK2 (0.45) MAPK1JAK2BRD4CDK7CDK9
SCHEMBL31334357 0.89 SYK (0.46) MAPK1CCNT1CDK7CDK9CCNH
SCHEMBL31335065 0.85 MAPK1 (0.45) MAPK1SYKPCSK9
SCHEMBL31333721 0.85 MAPK1 (0.45) MAPK1SYKPCSK9
SCHEMBL31334939 0.84 MAPK1 (0.44) MAPK1CDK2MAPK8SYKPCSK9
SCHEMBL31334050 0.84 MAPK1 (0.44) MAPK1CDK2MAPK8SYKPCSK9
SCHEMBL31334302 0.83 CCNT1 (0.43) MAPK1JAK2BRD4CCNT1CDK7
SCHEMBL31333940 0.83 MAPK1 (0.48) MAPK1SYK
SCHEMBL31334428 0.83 ADORA1 (0.53) MAPK1CCNT1CDK7CDK9CCNH
SCHEMBL31333658 0.83 ADORA1 (0.53) MAPK1CCNT1CDK7CDK9CCNH

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