SCHEMBL31444692

SCHEMBL31444692

COc1ccc(COc2cc3ccc(N)cc3cn2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 1/20 0.47
KDM4E B2RXH2 1/20 0.46
MEN1 O00255 1/20 0.46
ALDH1A1 P00352 1/20 0.46
LMNA P02545 1/20 0.46
GAA P10253 1/20 0.46
MAPT P10636 1/20 0.46
HPGD P15428 1/20 0.46
KMT2A Q03164 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
NPC1 O15118 3/20 0.45
RAB9A P51151 3/20 0.45
MAOB P27338 2/20 0.44
NTRK1 P04629 1/20 0.44
CSF1R P07333 1/20 0.44
NTRK3 Q16288 1/20 0.44
NTRK2 Q16620 1/20 0.44
IDO1 P14902 2/20 0.42
AGXT P21549 2/20 0.42
CASP3 P42574 1/20 0.42

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
SCHEMBL31444747 0.83 MAOB (0.48) PDE2AMEN1KMT2ANPC1RAB9A
SCHEMBL30184138 0.81 KDM4E (0.51) PDE2AKDM4EMEN1ALDH1A1KMT2A
SCHEMBL24869497 0.81 KDM4E (0.51) PDE2AKDM4EMEN1ALDH1A1KMT2A
SCHEMBL116626 0.81 NPC1 (0.54) PDE2AKDM4EMEN1ALDH1A1LMNA
SCHEMBL29417533 0.81 NPC1 (0.54) PDE2AKDM4EMEN1ALDH1A1LMNA
SCHEMBL29024744 0.80 ALDH1A1 (0.45) KDM4EMEN1ALDH1A1LMNAMAPT
SCHEMBL31694526 0.77 PDE2A (0.49) PDE2AMEN1ALDH1A1MAPTKMT2A
SCHEMBL31444661 0.76 MEN1 (0.45) PDE2AKDM4EMEN1ALDH1A1LMNA
SCHEMBL31046679 0.75 NPC1 (0.50) PDE2AALDH1A1MAPTSMN1; SMN2NPC1
SCHEMBL1025850 0.75 NPC1 (0.50) PDE2AALDH1A1MAPTSMN1; SMN2NPC1

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-2025096710-A1 MODULATORS OF BCL6 AS LIGAND DIRECTED DEGRADERS BRISTOL-MYERS SQUIBB COMPANY (US) 2025-05-08 WO disclosed