SCHEMBL913394

SCHEMBL913394

c1ccc(-c2ncc3ccccc3c2-c2ccccc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 5/20 0.64
TDP1 Q9NUW8 4/20 0.55
CTDSP1 Q9GZU7 2/20 0.55
TAAR1 Q96RJ0 2/20 0.49
KDM4E B2RXH2 1/20 0.45
GPR3 P46089 1/20 0.45
NPC1 O15118 1/20 0.43
LMNA P02545 1/20 0.42
CKS1B P61024 1/20 0.42
SKP1 P63208 1/20 0.42
SKP2 Q13309 1/20 0.42
ESR1 P03372 1/20 0.42
ESR2 Q92731 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
SCHEMBL29576853 1.00 AKT1 (0.64) AKT1TDP1CTDSP1TAAR1KDM4E
SCHEMBL14359556 0.94 AKT1 (0.57) AKT1TDP1CTDSP1TAAR1KDM4E
SCHEMBL18648904 0.80 AKT1 (0.46) AKT1TDP1CTDSP1TAAR1KDM4E
SCHEMBL12202297 0.79 AKT1 (0.49) AKT1TDP1CTDSP1TAAR1NPC1
SCHEMBL18104285 0.78 AKT1 (0.48) AKT1KDM4EGPR3NPC1LMNA
SCHEMBL11331611 0.78 KDM4E (0.53) AKT1TDP1KDM4EGPR3NPC1
SCHEMBL19055055 0.78 AKT1 (0.44) AKT1TDP1CTDSP1KDM4EGPR3
SCHEMBL24504040 0.78 AKT1 (0.44) AKT1TDP1CTDSP1KDM4EGPR3
SCHEMBL14359421 0.78 AKT1 (0.44) AKT1TDP1CTDSP1KDM4EGPR3
SCHEMBL17942576 0.78 AKT1 (0.48) AKT1TDP1CTDSP1KDM4EGPR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220363984-A1 PHOTO-RESPONSIVE COORDINATION COMPOUNDS WITH PHOTO-CONTROLLABLE ELECTRON-TRANSPORTING AND ELECTRICAL CONDUCTING PROPERTIES, AND FABRICATION OF ORGANIC ELECTRONICS AND ORGANIC RESISTIVE MEMORY DEVICES WITH PHOTO-SWITCHABLE PERFORMANCE THE UNIVERSITY OF HONG KONG (CN) 2022-11-17 US disclosed
CN-114423844-A Photoresponsive coordination compound with photocontrol electron transport and conduction characteristics and manufacture of organic electronic device and organic resistance memory device with photoconversion performance 香港大学 2022-04-29 CN disclosed
CN-102574870-B Luminescent gold (III) compound containing bidentate ligand for organic light-emitting device and preparation method thereof THE UNIVERSITY OF HONG KONG (CN) 2016-05-18 CN disclosed
US-8372977-B2 Luminescent gold(III) compounds containing bidentate ligand for organic light-emitting devices and their preparation THE UNIVERSITY OF HONG KONG (CN) 2013-02-12 US disclosed
US-20110012093-A1 LUMINESCENT GOLD(III) COMPOUNDS CONTAINING BIDENTATE LIGAND FOR ORGANIC LIGHT-EMITTING DEVICES AND THEIR PREPARATION THE UNIVERSITY OF HONG KONG (CN) 2011-01-20 US disclosed
WO-2011006353-A1 LUMINESCENT GOLD(III) COMPOUNDS CONTAINING BIDENTATE LIGAND FOR ORGANIC LIGHT-EMITTING DEVICES AND THEIR PREPARATION THE UNIVERSITY OF HONG KONG (CN) 2011-01-20 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20220363984-A1 PHOTO-RESPONSIVE COORDINATION COMPOUNDS WITH PHOTO-CONTROLLABLE ELECTRON-TRANSPORTING AND ELECTRICAL CONDUCTING PROPERTIES, AND FABRICATION OF ORGANIC ELECTRONICS AND ORGANIC RESISTIVE MEMORY DEVICES WITH PHOTO-SWITCHABLE PERFORMANCE L1CAM, SLC1A2, CLTB AKT1 3503/4885TDP1 3200/4885CTDSP1 3021/4885
US-20110012093-A1 LUMINESCENT GOLD(III) COMPOUNDS CONTAINING BIDENTATE LIGAND FOR ORGANIC LIGHT-EMITTING DEVICES AND THEIR PREPARATION CHRM1, CHRM5, CHRM2 AKT1 4447/4885TDP1 4615/4885CTDSP1 2467/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.