SCHEMBL30136675

SCHEMBL30136675

CC(C)(C)OC(=O)Nc1ccc(NC(=O)Oc2ccccc2)cn1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.51
MAPT P10636 2/20 0.51
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
KDM4E B2RXH2 1/20 0.48
THRB P10828 1/20 0.48
GFER P55789 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
TP53 P04637 2/20 0.47
GAA P10253 2/20 0.47
LMNA P02545 1/20 0.47
RAD51 Q06609 1/20 0.47
NAMPT P43490 1/20 0.46
LIPE Q05469 1/20 0.46
HDAC1 Q13547 1/20 0.46
FAAH O00519 6/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
HTT P42858 1/20 0.45

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
SCHEMBL24756649 1.00 ALDH1A1 (0.51) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL6609814 0.88 NAMPT (0.52) ALDH1A1TP53NAMPTHDAC1SMN1; SMN2
Acetic Acid SCHEMBL28111547 0.87 NAMPT (0.49) MAPTKMT2ANAMPTHDAC1SMN1; SMN2
SCHEMBL6815441 0.85 ALDH1A1 (0.69) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL24364346 0.82 PTPN11 (0.51) ALDH1A1MAPTKMT2AKDM4ETP53
SCHEMBL29141782 0.81 ALDH1A1 (0.44) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL30781986 0.81 ALDH1A1 (0.44) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL7324243 0.80 NAMPT (0.46) ALDH1A1TP53NAMPTHDAC1SMN1; SMN2
SCHEMBL23213608 0.79 ALDH1A1 (0.56) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL30582962 0.79 FAAH (0.48) ALDH1A1MAPTMEN1KMT2AKDM4E

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-4334298-A1 UREA DERIVATIVES WHICH CAN BE USED TO TREAT CANCER Scorpion Therapeutics, Inc. (US) 2024-03-13 EP disclosed
WO-2022265993-A1 UREA DERIVATIVES WHICH CAN BE USED TO TREAT CANCER SCORPION THERAPEUTICS, INC. (US) 2022-12-22 WO disclosed