SCHEMBL21240932

SCHEMBL21240932

CCc1cccc(NC(=O)C2CCC2)c1

nearest known ligand 0.94

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.94
NPSR1 Q6W5P4 1/20 0.62
ALDH1A1 P00352 1/20 0.59
MAPT P10636 4/20 0.58
MEN1 O00255 2/20 0.58
KMT2A Q03164 2/20 0.58
TDP1 Q9NUW8 1/20 0.58
RHOA P61586 1/20 0.57
ACKR3 P25106 3/20 0.57
LMNA P02545 1/20 0.56
TP53 P04637 1/20 0.55

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
SCHEMBL8298268 0.96 SMN1; SMN2 (0.97) SMN1; SMN2NPSR1ALDH1A1MAPTMEN1
SCHEMBL18774005 0.94 SMN1; SMN2 (0.89) SMN1; SMN2NPSR1ALDH1A1MAPTMEN1
SCHEMBL21923174 0.87 SMN1; SMN2 (0.78) SMN1; SMN2NPSR1ALDH1A1MAPTMEN1
SCHEMBL10076207 0.86 SMN1; SMN2 (0.74) SMN1; SMN2NPSR1ALDH1A1MAPTMEN1
SCHEMBL21231330 0.84 SMN1; SMN2 (0.72) SMN1; SMN2ALDH1A1MAPTMEN1KMT2A
SCHEMBL18658114 0.84 SMN1; SMN2 (0.72) SMN1; SMN2MAPTMEN1KMT2ATDP1
SCHEMBL13766293 0.83 SMN1; SMN2 (0.71) SMN1; SMN2NPSR1MAPTMEN1KMT2A
SCHEMBL23713332 0.83 SMN1; SMN2 (0.65) SMN1; SMN2NPSR1MAPTMEN1KMT2A
SCHEMBL15576241 0.82 SMN1; SMN2 (0.74) SMN1; SMN2NPSR1ALDH1A1ACKR3LMNA
SCHEMBL18640454 0.82 SMN1; SMN2 (0.74) SMN1; SMN2NPSR1ALDH1A1ACKR3LMNA

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-3587406-B1 2-HYDROXY-1-{4-[(4-PHENYLPHENYL)CARBONYL]PIPERAZIN-1-YL}ETHAN-1-ONE DERIVATIVES AND RELATED COMPOUNDS AS FATTY ACID SYNTHASE (FASN) INHIBITORS FOR THE TREATMENT OF CANCER FORMA THERAPEUTICS INC (US) 2021-01-27 EP disclosed
EP-2968316-B1 2-HYDROXY-1-{4-[(4-PHENYLPHENYL)CARBONYL]PIPERAZIN-1-YL}ETHAN-1-ONE DERIVATIVES AND RELATED COMPOUNDS AS FATTY ACID SYNTHASE (FASN) INHIBITORS FOR THE TREATMENT OF CANCER FORMA THERAPEUTICS INC (US) 2019-08-07 EP disclosed