SCHEMBL29062913

SCHEMBL29062913

COc1c(Cl)ccc2[nH]c(C(N)=O)cc12

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 2/20 0.44
RHEB Q15382 3/20 0.44
MAP2 P11137 2/20 0.42
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 2/20 0.41
HSD17B10 Q99714 1/20 0.41
HRH4 Q9H3N8 2/20 0.41
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
MAPT P10636 2/20 0.40
LMNA P02545 1/20 0.40
POLB P06746 1/20 0.40
HPGD P15428 1/20 0.40
PTBP1 P26599 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
BLM P54132 1/20 0.39
SIRT1 Q96EB6 1/20 0.38
HTR1A P08908 3/20 0.37
DRD2 P14416 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
SCHEMBL11743428 0.87 RHEB (0.51) FLT3RHEBALDH1A1KDM4EHSD17B10
SCHEMBL24021051 0.85 FLT3 (0.44) FLT3ALDH1A1KDM4EHSD17B10HRH4
SCHEMBL16031847 0.84 FLT3 (0.43) FLT3RHEBMAP2ALDH1A1KDM4E
SCHEMBL4785003 0.84 KMT2A (0.54) FLT3RHEBMAP2ALDH1A1KDM4E
SCHEMBL29738295 0.82 FLT3 (0.44) FLT3RHEBMAP2ALDH1A1KDM4E
SCHEMBL24028985 0.81 ALOX15 (0.53) FLT3ALDH1A1KDM4EMEN1KMT2A
SCHEMBL29063225 0.80 RHEB (0.42) FLT3RHEBMAP2ALDH1A1KDM4E
SCHEMBL29063128 0.79 RHEB (0.47) FLT3RHEBMAP2ALDH1A1KDM4E
SCHEMBL29062784 0.73 KDM4E (0.57) FLT3RHEBMAP2ALDH1A1KDM4E
SCHEMBL20505087 0.73 FLT3 (0.57) FLT3RHEBMAP2ALDH1A1KDM4E

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
CN-116685576-A Cysteine protease inhibitors and methods of use thereof 美商帕迪斯生物科学公司 2023-09-01 CN disclosed