SCHEMBL25567562

SCHEMBL25567562

CC(C)(C)c1cc(NC(=O)C2(C(=O)Nc3ccc4c(c3)NC(=O)C4)CC2)no1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 1/20 0.47
▸ MAPK14 Q16539 2/20 0.44
▸ CSF1R P07333 7/20 0.43
▸ FLT3 P36888 3/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ RAF1 P04049 3/20 0.42
▸ CNR1 P21554 2/20 0.42
▸ CNR2 P34972 2/20 0.42
▸ TRPV1 Q8NER1 1/20 0.42
▸ MAPK13 O15264 1/20 0.41
▸ MAPK12 P53778 1/20 0.41
▸ MAPK11 Q15759 1/20 0.41

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
SCHEMBL25567722 0.89 MAPK14 (0.46) HPGDMAPK14CSF1RFLT3MEN1
SCHEMBL25564759 0.89 MAPK14 (0.58) MAPK14CSF1RFLT3MEN1NPC1
SCHEMBL25567190 0.87 EGFR (0.49) HPGDMAPK14CSF1RFLT3MEN1
SCHEMBL25567547 0.77 HPGD (0.61) HPGDMAPK14FLT3MEN1NPC1
SCHEMBL25565993 0.74 ALDH1A1 (0.58) FLT3MEN1NPC1RAB9AKMT2A
SCHEMBL25567124 0.73 EGFR (0.46) HPGDMAPK14CSF1RFLT3MEN1
SCHEMBL25567247 0.73 MAPK14 (0.59) MAPK14CSF1RFLT3RAF1TRPV1
SCHEMBL25567538 0.73 HPGD (0.59) HPGDMAPK14MEN1NPC1RAB9A
SCHEMBL25565806 0.72 RAB9A (0.58) MAPK14CSF1RFLT3MEN1NPC1
SCHEMBL10576398 0.71 CMA1 (0.49) MEN1KMT2ATRPV1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023078207-A1 6-POSITION-SUBSTITUTED INDOLINONE DERIVATIVE, PREPARATION METHOD THEREFOR, AND MEDICAL USE THEREOF 南京中医药大学 2023-05-11 — — WO disclosed
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