SCHEMBL24174397

SCHEMBL24174397

CCc1nc(C(C)(C)C)c2cccnn12

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HTR2C P28335 1/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
PDE4A P27815 1/20 0.31
RECQL P46063 1/20 0.31
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31
CDK4 P11802 1/20 0.30
KDR P35968 1/20 0.30
RAB9A P51151 1/20 0.30

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
SCHEMBL24174412 0.78 PDE4A (0.31) PDE10AMEN1KMT2APDE4ACDK4
SCHEMBL24996407 0.77
SCHEMBL24175533 0.74 LMNA (0.31)
SCHEMBL14614237 0.72 MAPT (0.51) HTR2CMEN1KMT2AKDM4EALDH1A1
SCHEMBL25054415 0.71 PDE4A (0.43) PDE4A
SCHEMBL12997418 0.66 DYRK1A (0.36) CDK4KDR
SCHEMBL25054362 0.66 PDE4A (0.41) PDE4A
SCHEMBL25054390 0.66 PDE4A (0.38) PDE4A
SCHEMBL24408206 0.65 TGFBR1 (0.32) HPGDTSHR
SCHEMBL25054388 0.65 PDE4A (0.40) PDE4A

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-2022002118-A1 FUSED-RING HETEROCYCLE DERIVATIVE AND MEDICAL USE THEREOF 四川海思科制药有限公司 2022-01-06 WO disclosed