SCHEMBL11268402

SCHEMBL11268402

O=c1ccn(N=Cc2ccccc2)c(=O)[nH]1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 3/20 0.47
DDB1 Q16531 1/20 0.47
NPC1 O15118 3/20 0.43
RAB9A P51151 3/20 0.43
ALOX15 P16050 3/20 0.43
ALDH1A1 P00352 3/20 0.43
LMNA P02545 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
PKM P14618 1/20 0.40
KMT2A Q03164 7/20 0.39
MAPT P10636 7/20 0.39
MEN1 O00255 6/20 0.39
GAA P10253 5/20 0.39
TAAR1 Q96RJ0 1/20 0.38
APAF1 O14727 1/20 0.38
KDM4C Q9H3R0 1/20 0.38
KDM4E B2RXH2 5/20 0.38
NPSR1 Q6W5P4 1/20 0.38
APOBEC3G Q9HC16 2/20 0.37
MAPK1 P28482 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
SCHEMBL11268394 1.00 CRBN (0.47) CRBNDDB1NPC1RAB9AALOX15
SCHEMBL9266208 0.72 CRBN (0.41) CRBNDDB1PKM
SCHEMBL23119506 0.70 CRBN (0.50) CRBNDDB1ALDH1A1LMNAPKM
SCHEMBL21439798 0.70 ALOX15 (0.67) NPC1RAB9AALOX15ALDH1A1LMNA
SCHEMBL21439799 0.70 ALOX15 (0.67) NPC1RAB9AALOX15ALDH1A1LMNA
SCHEMBL7056284 0.69 CRBN (0.45) CRBNDDB1ALDH1A1LMNAPKM
SCHEMBL9661028 0.67 ALOX15 (0.54) NPC1RAB9AALOX15ALDH1A1LMNA
SCHEMBL10410969 0.67 ALOX15 (0.54) NPC1RAB9AALOX15ALDH1A1LMNA
SCHEMBL28252568 0.66 CRBN (0.45) CRBNDDB1ALDH1A1LMNAPKM
SCHEMBL11713868 0.66 CRBN (0.50) CRBNDDB1ALDH1A1LMNAPKM

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
US-4348518-A Cephalosporins HOFFMANN-LA ROCHE INC. (US) 1982-09-07 US disclosed
US-4091211-A ANTIBIOTICS HOFFMANN-LA ROCHE INC. (US) 1978-05-23 US disclosed