SCHEMBL10632545

SCHEMBL10632545

COc1c(Cl)cc(CCl)cc1Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.46
KDM4E B2RXH2 1/20 0.46
GAA P10253 1/20 0.46
DBH P09172 1/20 0.45
HTR1A P08908 3/20 0.41
DRD2 P14416 3/20 0.41
DRD4 P21917 3/20 0.41
HTR2A P28223 3/20 0.41
HTR2C P28335 3/20 0.41
DRD3 P35462 3/20 0.41
TTR P02766 1/20 0.40
KMT2A Q03164 4/20 0.38
MEN1 O00255 3/20 0.38
THRB P10828 1/20 0.37
RORC P51449 1/20 0.37
TPMT P51580 1/20 0.37
PTGS2 P35354 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
YTHDC1 Q96MU7 1/20 0.36
TAS1R3 Q7RTX0 1/20 0.35

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
SCHEMBL2388964 0.84 MAPT (0.50) ALDH1A1KDM4EGAADBHHTR1A
SCHEMBL19629677 0.81 PTGS2 (0.58) ALDH1A1KDM4EGAADBHHTR1A
SCHEMBL6941573 0.79 ALDH1A1 (0.44) ALDH1A1KDM4EGAADBHHTR1A
SCHEMBL6943761 0.79 KDM4E (0.48) ALDH1A1KDM4EGAADBHHTR1A
SCHEMBL11845896 0.77 ALDH1A1 (0.43) ALDH1A1KDM4EGAADBHHTR1A
Hydrochloric Acid SCHEMBL3113761 0.77 KDM4E (0.47) ALDH1A1KDM4EGAADBHHTR1A
SCHEMBL1706883 0.76 PTGS2 (0.64) KDM4EHTR2AHTR2CPTGS2MAPT
SCHEMBL29208987 0.76 MAPT (0.42) ALDH1A1HTR2AHTR2CTTRKMT2A
SCHEMBL4597547 0.76 DHFR (0.41) ALDH1A1KDM4EGAAHTR2AHTR2C
SCHEMBL4835197 0.76 GAA (0.46) ALDH1A1KDM4EGAADBHHTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024105159-A1 LIGANDS OF THE M6A-RNA READERS UNIVERSITY OF ZURICH (CH) 2024-05-23 WO disclosed
US-4760180-A N-terminally substituted dipeptide amides G. D. SEARLE & CO. (US) 1988-07-26 US disclosed
EP-0213481-A2 N-terminally substituted dipeptide amides No. 2 G.D. Searle & Co. (US) 1987-03-11 EP disclosed