SCHEMBL3101723

SCHEMBL3101723

OB(O)c1ccc2c(c1)Cc1cc(B(O)O)ccc1-2

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.42
MAPT P10636 2/20 0.42
RAB9A P51151 2/20 0.42
CA2 P00918 3/20 0.41
CA1 P00915 2/20 0.41
ENPP2 Q13822 6/20 0.41
MGLL Q99685 1/20 0.38
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.38
TTR P02766 1/20 0.38
LMNA P02545 1/20 0.38
HPGD P15428 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
SRD5A2 P31213 1/20 0.37
TSHR P16473 1/20 0.37
LPL P06858 1/20 0.37
LIPG Q9Y5X9 1/20 0.37

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
SCHEMBL257860 0.90 NPC1 (0.53) NPC1MAPTRAB9ACA2CA1
SCHEMBL30088382 0.90 NPC1 (0.53) NPC1MAPTRAB9ACA2CA1
SCHEMBL6018225 0.88 ENPP2 (0.48) NPC1MAPTRAB9ACA2CA1
SCHEMBL5497676 0.84 MAPT (0.47) NPC1MAPTRAB9ACA2CA1
SCHEMBL3794329 0.81 NPC1 (0.48) NPC1MAPTRAB9ACA2CA1
SCHEMBL28465873 0.81 SRD5A2 (0.47) NPC1MAPTRAB9ACA2CA1
SCHEMBL12759201 0.78 CA2 (0.43) CA2CA1ENPP2MGLLKDM4E
SCHEMBL19149267 0.78 NPC1 (0.32) NPC1MAPTRAB9A
SCHEMBL21579186 0.77 ENPP2 (0.39) CA2CA1ENPP2MGLLKDM4E
SCHEMBL14379322 0.76 RAB9A (0.42) NPC1MAPTRAB9AKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117924671-A Polymer semiconductor material containing benzene or pyridine ethynyl triphenylamine, hole transport material formed by crosslinking of polymer semiconductor material and application of hole transport material 华南理工大学 2024-04-26 CN claimed
CN-117924671-A Polymer semiconductor material containing benzene or pyridine ethynyl triphenylamine, hole transport material formed by crosslinking of polymer semiconductor material and application of hole transport material 华南理工大学 2024-04-26 CN disclosed
CN-108473864-B Nanoparticles for light emitting applications 克罗米顿有限公司 2022-03-01 CN disclosed
CN-108472392-B Nanoparticle conjugates 克罗米顿有限公司 2021-12-28 CN disclosed
WO-2010123692-A1 OPTOELECTRONIC DEVICES AND ORGANIC COMPOUNDS USED THEREIN GENERAL ELECTRIC COMPANY (US) 2010-10-28 WO disclosed
US-7803885-B2 Pentathienyl-fluorene copolymer DOW GLOBAL TECHNOLOGIES INC. (US) 2010-09-28 US disclosed
US-20070210302-A1 Pentathienyl-Fluorene Copolymer DOW GLOBAL TECHNOLOGIES LLC 2007-09-13 US disclosed
WO-2005092947-A1 PENTATHIENYL-FLUORENE COPOLYMER DOW GLOBAL TECHNOLOGIES INC. (US) 2005-10-06 WO disclosed