SCHEMBL30935784

SCHEMBL30935784

CCOC(=O)c1cnc2cc(OCC(C)O)ccn12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.47
KDM4E B2RXH2 3/20 0.47
GLA P06280 3/20 0.47
ALDH1A1 P00352 2/20 0.47
HPGD P15428 2/20 0.47
PIK3CD O00329 1/20 0.41
PIK3R1 P27986 1/20 0.41
PIK3CA P42336 1/20 0.41
PIK3CB P42338 1/20 0.41
PIK3CG P48736 1/20 0.41
CSF1R P07333 2/20 0.41
TGFBR1 P36897 2/20 0.39
NPC1 O15118 3/20 0.38
RAB9A P51151 3/20 0.38
CYP1A2 P05177 3/20 0.37
CYP3A4 P08684 2/20 0.37
GABRA1 P14867 2/20 0.37
GABRB2 P47870 2/20 0.37
CYP11B1 P15538 2/20 0.37
CYP11B2 P19099 2/20 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
SCHEMBL17437845 0.88 KDM4E (0.47) GAAKDM4EGLAALDH1A1HPGD
SCHEMBL16370033 0.88 KDM4E (0.53) GAAKDM4EGLAALDH1A1HPGD
SCHEMBL16369955 0.84 KDM4E (0.52) GAAKDM4EGLAALDH1A1HPGD
SCHEMBL9941921 0.83 KDM4E (0.49) GAAKDM4EGLAALDH1A1HPGD
SCHEMBL14739137 0.83 KDM4E (0.49) GAAKDM4EGLAALDH1A1HPGD
SCHEMBL731532 0.82 CSF1R (0.49) GAAKDM4EGLAALDH1A1HPGD
SCHEMBL17437968 0.82 KDM4E (0.50) GAAKDM4EGLAALDH1A1HPGD
SCHEMBL30935502 0.81 KDM4E (0.47) GAAKDM4EGLAALDH1A1HPGD
SCHEMBL25967061 0.81 KDM4E (0.47) GAAKDM4EGLAALDH1A1HPGD
SCHEMBL19697643 0.81 KDM4E (0.51) GAAKDM4EGLAALDH1A1HPGD

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-4630424-A1 COMPOUNDS AND COMPOSITIONS AS C-KIT KINASE INHIBITORS Third Harmonic Bio, Inc. (US) 2025-10-15 EP disclosed
WO-2024124002-A1 COMPOUNDS AND COMPOSITIONS AS C-KIT KINASE INHIBITORS THIRD HARMONIC BIO, INC. (US) 2024-06-13 WO disclosed