SCHEMBL9525840

SCHEMBL9525840

COc1ccccc1C(=O)c1ccccn1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.71
NPC1 O15118 6/20 0.62
SMN1; SMN2 Q16637 3/20 0.57
KMT2A Q03164 2/20 0.57
CNR2 P34972 1/20 0.57
MEN1 O00255 1/20 0.57
TP53 P04637 1/20 0.57
GAA P10253 1/20 0.57
KDM4E B2RXH2 2/20 0.51
ALDH1A1 P00352 2/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
HSD17B10 Q99714 1/20 0.50
CDK5 Q00535 1/20 0.49
CDK5R1 Q15078 1/20 0.49
GRM4 Q14833 4/20 0.49
HDAC6 Q9UBN7 1/20 0.49
CES2 O00748 1/20 0.48
CES1 P23141 1/20 0.48
POLB P06746 1/20 0.48

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
SCHEMBL30118936 1.00 RAB9A (0.71) RAB9ANPC1SMN1; SMN2KMT2ACNR2
SCHEMBL7617859 0.88 RAB9A (0.65) RAB9ANPC1SMN1; SMN2KMT2ACNR2
SCHEMBL30048914 0.88 RAB9A (0.60) RAB9ANPC1SMN1; SMN2KMT2ACNR2
SCHEMBL30118960 0.84 RAB9A (0.64) RAB9ANPC1SMN1; SMN2KMT2AMEN1
SCHEMBL22426339 0.84 RAB9A (0.64) RAB9ANPC1SMN1; SMN2KMT2AMEN1
SCHEMBL22406337 0.84 RAB9A (0.60) RAB9ANPC1SMN1; SMN2KMT2ACNR2
SCHEMBL30118904 0.84 RAB9A (0.60) RAB9ANPC1SMN1; SMN2KMT2ACNR2
SCHEMBL5624004 0.82 RAB9A (0.73) RAB9ANPC1SMN1; SMN2KDM4EALDH1A1
SCHEMBL22406333 0.82 RAB9A (0.57) RAB9ANPC1SMN1; SMN2KMT2AKDM4E
SCHEMBL22406356 0.82 RAB9A (0.57) RAB9ANPC1SMN1; SMN2KMT2AMEN1

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 28 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3938364-B1 COMPOUNDS FOR AND METHODS OF TREATING DISEASES ALTERITY THERAPEUTICS LTD (AU) 2023-08-23 EP disclosed
EP-3938364-B1 COMPOUNDS FOR AND METHODS OF TREATING DISEASES ALTERITY THERAPEUTICS LTD (AU) 2023-08-23 EP disclosed
EP-4168408-A1 COMPOUNDS FOR AND METHODS OF TREATING DISEASES Alterity Therapeutics Limited (AU) 2023-04-26 EP disclosed
CN-110563641-B Ortho-halogenated phenyl pyridine ketone compound and preparation method thereof 三峡大学 2023-03-24 CN disclosed
EP-3938364-A1 COMPOUNDS FOR AND METHODS OF TREATING DISEASES Alterity Therapeutics Limited (AU) 2022-01-19 EP disclosed
WO-2021253091-A1 COMPOUNDS FOR AND METHODS OF TREATING DISEASES Alterity Therapeutics Limited (AU) 2021-12-23 WO disclosed
WO-2021253091-A1 COMPOUNDS FOR AND METHODS OF TREATING DISEASES Alterity Therapeutics Limited (AU) 2021-12-23 WO disclosed
US-11155547-B1 Compounds for and methods of treating diseases Alterity Therapeutics Limited (AU) 2021-10-26 US disclosed
US-11155547-B1 Compounds for and methods of treating diseases Alterity Therapeutics Limited (AU) 2021-10-26 US disclosed
EP-3233799-B1 DOPAMINE D2 RECEPTOR LIGANDS BROAD INST INC (US) 2021-05-19 EP disclosed
US-20190345105-A9 DOPAMINE D2 RECEPTOR LIGANDS THE BROAD INSTITUTE, INC. (US) 2019-11-14 US disclosed
US-20190023656-A1 DOPAMINE D2 RECEPTOR LIGANDS THE BROAD INSTITUTE, INC. (US) 2019-01-24 US disclosed
EP-3233799-A1 DOPAMINE D2 RECEPTOR LIGANDS The Broad Institute Inc. (US) 2017-10-25 EP disclosed
WO-2016100823-A1 DOPAMINE D2 RECEPTOR LIGANDS THE BROAD INSTITUTE, INC. (US) 2016-06-23 WO disclosed
CN-1023404-C Process for producing benzopyran derivative HOFFMANN LA ROCHE (CH) 1994-01-05 CN disclosed
EP-0298452-B1 2H-1-BENZOPYRANE DERIVATIVES SUBSTITUTED IN POSITION 4 BY ARYL OR N-HETEROARYL F. HOFFMANN-LA ROCHE AG (CH) 1993-06-30 EP disclosed
US-5118694-A Hypotensive agents; treatment for cardiovascular and muscular disorders HOFFMANN-LA ROCHE INC. (US) 1992-06-02 US disclosed
US-4971982-A HYPOTENSIVE AGENTS, CARDIOVASCULAR DISORDERS, SMOOTH MUSCLE DISORDERS HOFFMANN-LA ROCHE INC. (US) 1990-11-20 US disclosed
CN-1030582-A 1-benzopyran derivatives HOFFMANN LA ROCHE (CH) 1989-01-25 CN disclosed
EP-0298452-A2 2H-1-benzopyrane derivatives substituted in position 4 by aryl or N-heteroaryl F. HOFFMANN-LA ROCHE AG (CH) 1989-01-11 EP 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 (3 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-20190345105-A9 DOPAMINE D2 RECEPTOR LIGANDS DRD2, SLC6A3, NTSR2 RAB9A 906/4885NPC1 2458/4885SMN1; SMN2 1443/4885
US-11155547-B1 Compounds for and methods of treating diseases HTT, SNCA, PARK7 RAB9A 1452/4885NPC1 277/4885SMN1; SMN2 10/4885
US-20190023656-A1 DOPAMINE D2 RECEPTOR LIGANDS DRD2, SLC6A3, NTSR2 RAB9A 906/4885NPC1 2458/4885SMN1; SMN2 1443/4885

“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.