SCHEMBL26052011

SCHEMBL26052011

CCc1ccc2c(C(C)C)cnn2c1

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
KMT2A Q03164 1/20 0.32
KLF5 Q13887 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32

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
SCHEMBL26052008 0.83 PDE1A (0.31)
SCHEMBL26052151 0.83 GSR (0.39)
SCHEMBL26671795 0.80 HRH3 (0.39)
SCHEMBL26671801 0.80 NR3C1 (0.32)
SCHEMBL23109050 0.77 EPHB3 (0.39)
SCHEMBL26671829 0.77 DRD4 (0.44) NPC1RAB9A
SCHEMBL26052153 0.76 MAPT (0.49) SMN1; SMN2
SCHEMBL10499639 0.76 TRPA1 (0.38) MEN1NPC1RAB9AKMT2AKLF5
SCHEMBL21849298 0.76 KCNH2 (0.37)
SCHEMBL24370198 0.76 EPHB3 (0.40)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023164237-A1 COMPOUNDS AND METHODS USEFUL FOR STABILIZING PHENYLALANINE HYDROXYLASE MUTATIONS AGIOS PHARMACEUTICALS, INC. (US) 2023-08-31 WO disclosed