SCHEMBL10757205

SCHEMBL10757205

CC(C)CNC(=O)NC(=N)Nc1ccco1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.45
TP53 P04637 1/20 0.45
ALPL P05186 1/20 0.45
LMNA P02545 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
NPC1 O15118 2/20 0.43
HTT P42858 2/20 0.43
RAB9A P51151 2/20 0.43
HPGD P15428 1/20 0.43
POLB P06746 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
KDM4C Q9H3R0 1/20 0.40
KMT2A Q03164 2/20 0.39
HSD17B10 Q99714 1/20 0.39
ALDH1A1 P00352 4/20 0.39
KDM4E B2RXH2 2/20 0.38
MEN1 O00255 1/20 0.37
MAPT P10636 1/20 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
SCHEMBL10754708 0.84 PTPN7 (0.43) GAATP53LMNASMN1; SMN2NPC1
SCHEMBL10756983 0.82 KDM4C (0.41) GAALMNASMN1; SMN2NPC1RAB9A
SCHEMBL10756902 0.82 USP2 (0.46) GAASMN1; SMN2HTTHPGDPOLB
SCHEMBL10756747 0.82 KDM4C (0.43) GAATP53LMNASMN1; SMN2NPC1
SCHEMBL10758718 0.82 RAB9A (0.43) LMNASMN1; SMN2NPC1RAB9AHPGD
SCHEMBL10756419 0.81 EPHX1 (0.47) LMNASMN1; SMN2HTTTDP1ALDH1A1
SCHEMBL10757877 0.81 ALDH1A1 (0.50) GAATP53LMNASMN1; SMN2NPC1
SCHEMBL10755892 0.80 EPHX1 (0.49) LMNASMN1; SMN2HTTTDP1ALDH1A1
SCHEMBL10756172 0.80 EPHX1 (0.49) LMNASMN1; SMN2HTTTDP1ALDH1A1
SCHEMBL10756733 0.79 RAB9A (0.55) LMNASMN1; SMN2NPC1RAB9APOLB

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
US-4707478-A ANTIPROTOZOA AGENTS RORER PHARMACEUTICAL CORPORATION (US) 1987-11-17 US disclosed