SCHEMBL7985240

SCHEMBL7985240

CCCOC(=O)NC(=N)c1cc[c]nc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.38
ALDH1A1 P00352 5/20 0.38
MAPK1 P28482 2/20 0.38
HPGD P15428 3/20 0.36
MASP2 O00187 2/20 0.36
LMNA P02545 2/20 0.35
CSNK2A2 P19784 1/20 0.34
CSNK2A1 P68400 1/20 0.34
NPC1 O15118 3/20 0.34
RAB9A P51151 3/20 0.34
ESR1 P03372 1/20 0.34
CHRM1 P11229 1/20 0.34
TSHR P16473 1/20 0.34
SLC6A2 P23975 1/20 0.34
KDR P35968 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
TP53 P04637 2/20 0.34
USP2 O75604 1/20 0.34
MAPT P10636 1/20 0.34

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
SCHEMBL7988847 0.92 RAB9A (0.43) SMN1; SMN2ALDH1A1MAPK1HPGDMASP2
SCHEMBL7991993 0.89 DGAT1 (0.36) SMN1; SMN2ALDH1A1MAPK1HPGDMASP2
SCHEMBL7975249 0.85 HRH3 (0.30)
SCHEMBL7992134 0.82 SMN1; SMN2 (0.42) SMN1; SMN2ALDH1A1MAPK1HPGDMASP2
SCHEMBL7987416 0.81
SCHEMBL7986497 0.80 POLB (0.42) SMN1; SMN2MASP2LMNASLC6A2TDP1
SCHEMBL7969069 0.79 LMNA (0.53) SMN1; SMN2ALDH1A1MAPK1HPGDLMNA
SCHEMBL7985722 0.78 ALDH1A1 (0.38) SMN1; SMN2ALDH1A1MAPK1LMNATSHR
SCHEMBL7992358 0.75 HPGD (0.44) SMN1; SMN2ALDH1A1MAPK1HPGDMASP2
SCHEMBL7975316 0.75 SMN1; SMN2 (0.36) SMN1; SMN2ALDH1A1MAPK1HPGDMASP2

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-6265418-B1 ANTICOAGULANTS UBE INDUSTRIES, LTD. (JP) 2001-07-24 US disclosed
EP-1020467-A1 N-ACYLAMINO ACID AMIDE COMPOUNDS AND INTERMEDIATES FOR PREPARATION THEREOF UBE INDUSTRIES LIMITED (JP) 2000-07-19 EP disclosed