SCHEMBL31334683

SCHEMBL31334683

CC(=O)N[C@H]1CC[C@H](Nc2ncc(Cl)c(-c3cccc(-c4ccc(F)cc4)n3)n2)CC1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CCNT1 O60563 3/20 0.48
HDAC1 Q13547 1/20 0.45
ADRA2A P08913 1/20 0.43
ADRA1A P35348 1/20 0.43
HRH1 P35367 1/20 0.43
HTR2B P41595 1/20 0.43
MCHR1 Q99705 1/20 0.43
MAPK8 P45983 3/20 0.42
MAPK14 Q16539 1/20 0.42
MAPK9 P45984 2/20 0.42
MAPK10 P53779 2/20 0.42
ADORA1 P30542 2/20 0.41
ADORA2A P29274 1/20 0.41
MERTK Q12866 1/20 0.41
MAPK1 P28482 7/20 0.40
JUN P05412 2/20 0.40
CDK2 P24941 1/20 0.40

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
SCHEMBL31334103 1.00 CCNT1 (0.48) CCNT1HDAC1ADRA2AADRA1AHRH1
SCHEMBL31334363 0.87 CCNT1 (0.49) CCNT1HDAC1MAPK8MAPK14MAPK9
SCHEMBL31334491 0.87 CDK2 (0.53) CCNT1MAPK8MAPK14MAPK9MAPK10
SCHEMBL31335021 0.87 CCNT1 (0.49) CCNT1HDAC1MAPK8MAPK14MAPK9
SCHEMBL31334826 0.85 MAPK1 (0.45) ADRA2AADRA1AHRH1HTR2BMCHR1
SCHEMBL31334287 0.83 CCNT1 (0.42) CCNT1HDAC1MAPK8MAPK9MAPK10
SCHEMBL31334976 0.83 CCNT1 (0.42) CCNT1HDAC1MAPK8MAPK9MAPK10
SCHEMBL31334299 0.82 MAPK3 (0.52) CCNT1MAPK8MAPK9MAPK10MAPK1
SCHEMBL31334822 0.79 ADORA1 (0.51) MAPK8MAPK14ADORA1ADORA2AMAPK1
SCHEMBL31334996 0.79 ADORA1 (0.51) MAPK8MAPK14ADORA1ADORA2AMAPK1

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