SCHEMBL25567722

SCHEMBL25567722

CC(C)(C(=O)Nc1ccc2c(c1)NC(=O)C2)C(=O)Nc1cc(C(C)(C)C)on1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAPK14 Q16539 2/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ NPC1 O15118 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ CSF1R P07333 7/20 0.45
▸ FLT3 P36888 5/20 0.45
▸ KDR P35968 1/20 0.45
▸ HPGD P15428 1/20 0.44
▸ TRPV1 Q8NER1 1/20 0.44
▸ RAF1 P04049 2/20 0.43
▸ MAPK13 O15264 1/20 0.43
▸ MAPK12 P53778 1/20 0.43
▸ MAPK11 Q15759 1/20 0.43

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
SCHEMBL25564759 0.91 MAPK14 (0.58) MAPK14MEN1NPC1RAB9AKMT2A
SCHEMBL25567190 0.89 EGFR (0.49) MAPK14MEN1NPC1RAB9AKMT2A
SCHEMBL25567562 0.89 HPGD (0.47) MAPK14MEN1NPC1RAB9AKMT2A
SCHEMBL10576398 0.79 CMA1 (0.49) MEN1KMT2ATRPV1
SCHEMBL25565993 0.76 ALDH1A1 (0.58) MEN1NPC1RAB9AKMT2AFLT3
SCHEMBL25567124 0.76 EGFR (0.46) MAPK14MEN1NPC1RAB9AKMT2A
SCHEMBL25567247 0.75 MAPK14 (0.59) MAPK14CSF1RFLT3KDRTRPV1
SCHEMBL25565806 0.74 RAB9A (0.58) MAPK14MEN1NPC1RAB9AKMT2A
SCHEMBL25566546 0.73 TRPV1 (0.57) MEN1NPC1RAB9AKMT2ACSF1R
SCHEMBL3662896 0.73 CRBN (0.52) —

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
Send feedback