SCHEMBL30345264

SCHEMBL30345264

COc1ccc2nc(Cl)c(C=O)cc2c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.59
GSK3B P49841 1/20 0.57
CYP1A2 P05177 1/20 0.57
CYP3A4 P08684 1/20 0.57
CYP2D6 P10635 1/20 0.57
CYP2C19 P33261 1/20 0.57
ALDH1A1 P00352 4/20 0.54
KDM4E B2RXH2 3/20 0.54
KMT2A Q03164 2/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
RAB9A P51151 2/20 0.52
MAPT P10636 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
TRIM24 O15164 1/20 0.51
TYR P14679 1/20 0.51
TRIM33 Q9UPN9 1/20 0.51
HCAR2 Q8TDS4 1/20 0.49
ERN1 O75460 1/20 0.47
NPC1 O15118 1/20 0.47
MEN1 O00255 1/20 0.46

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
SCHEMBL1957586 1.00 EGFR (0.59) EGFRGSK3BCYP1A2CYP3A4CYP2D6
SCHEMBL31105770 0.89 KDM4E (0.68) EGFRGSK3BCYP1A2CYP3A4CYP2D6
SCHEMBL3210785 0.89 KDM4E (0.68) EGFRGSK3BCYP1A2CYP3A4CYP2D6
SCHEMBL4403031 0.84 EGFR (0.55) EGFRGSK3BCYP1A2ALDH1A1KDM4E
SCHEMBL11996253 0.83 KDM4E (0.59) EGFRGSK3BCYP1A2ALDH1A1KDM4E
SCHEMBL6303683 0.83 ALDH1A1 (0.58) EGFRGSK3BCYP1A2CYP3A4CYP2D6
SCHEMBL4715292 0.81 EGFR (0.46) EGFRGSK3BCYP1A2CYP3A4CYP2D6
SCHEMBL28970665 0.81 ALDH1A1 (0.53) EGFRGSK3BCYP1A2CYP2C19ALDH1A1
SCHEMBL27003032 0.81 ALDH1A1 (0.53) EGFRGSK3BCYP1A2CYP2C19ALDH1A1
SCHEMBL16764730 0.81 TRIM24 (0.60) EGFRCYP1A2ALDH1A1KDM4EKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4416146-A1 SUBSTITUTED 1H-PYRAZOLO [4,3-C] QUINOLINES, METHODS OF PREPARATION, AND USE THEREOF Lomond Therapeutics, Inc. (US) 2024-08-21 EP disclosed
WO-2023064133-A1 SUBSTITUTED 1H-PYRAZOLO [4,3-c] QUINOLINES, METHODS OF PREPARATION, AND USE THEREOF LOMOND THERAPEUTICS, INC. (US) 2023-04-20 WO disclosed