SCHEMBL11240871

SCHEMBL11240871

CCOC(=O)C1(F)C(=O)NC(=O)NC1NCc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TP53 P04637 4/20 0.41
THRB P10828 1/20 0.41
PPID Q08752 1/20 0.41
MAPT P10636 2/20 0.40
SMN1; SMN2 Q16637 3/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C19 P33261 1/20 0.38
HPGD P15428 1/20 0.37
NAMPT P43490 1/20 0.37
MMP13 P45452 1/20 0.37
LMNA P02545 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
SCHEMBL11245331 0.84 SMN1; SMN2 (0.41) TP53MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL11243162 0.79 SMN1; SMN2 (0.36) TP53MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL11241064 0.78 MEN1 (0.43) TP53MAPTMEN1KMT2ACYP1A2
SCHEMBL11237640 0.78 MEN1 (0.36) SMN1; SMN2MEN1KMT2ALMNA
SCHEMBL11236106 0.77 LMNA (0.41) TP53MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL11235754 0.75 MEN1 (0.40) TP53MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL11249308 0.74 POLB (0.41) TP53MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL11488879 0.73 TP53 (0.37) TP53MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL11488880 0.73 TP53 (0.37) TP53MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL11233822 0.72 ALDH1A1 (0.42) TP53MAPTSMN1; SMN2MEN1KMT2A

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-4329460-A ANTICANCER AGENTS, ANTIVIRAL AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1982-05-11 US disclosed