SCHEMBL7992358

SCHEMBL7992358

CCCOC(=O)NC(=N)c1cc[c]c(F)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.44
SMN1; SMN2 Q16637 7/20 0.40
ALDH1A1 P00352 3/20 0.40
MAPK1 P28482 2/20 0.40
RAB9A P51151 6/20 0.37
LMNA P02545 3/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
NPC1 O15118 5/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
MASP2 O00187 1/20 0.34
TP53 P04637 2/20 0.34
CSNK2A2 P19784 1/20 0.34
CSNK2A1 P68400 1/20 0.34
ESR1 P03372 1/20 0.33
CHRM1 P11229 1/20 0.33
TSHR P16473 1/20 0.33
SLC6A2 P23975 1/20 0.33

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
SCHEMBL7985688 0.93 RAB9A (0.46) HPGDSMN1; SMN2ALDH1A1MAPK1RAB9A
SCHEMBL7989160 0.90 KDM4E (0.40) HPGDSMN1; SMN2ALDH1A1MAPK1RAB9A
SCHEMBL7975142 0.85 HPGD (0.32) HPGDALDH1A1LMNA
SCHEMBL7992134 0.81 SMN1; SMN2 (0.42) HPGDSMN1; SMN2ALDH1A1MAPK1RAB9A
SCHEMBL7986786 0.78
SCHEMBL7989636 0.76 KDM4E (0.39) HPGDSMN1; SMN2ALDH1A1MAPK1NPC1
SCHEMBL7989503 0.75 CYP1A2 (0.40) HPGDALDH1A1RAB9ALMNAMEN1
SCHEMBL7985240 0.75 SMN1; SMN2 (0.38) HPGDSMN1; SMN2ALDH1A1MAPK1RAB9A
SCHEMBL7975316 0.74 SMN1; SMN2 (0.36) HPGDSMN1; SMN2ALDH1A1MAPK1RAB9A
SCHEMBL7988467 0.74 SMN1; SMN2 (0.40) SMN1; SMN2ALDH1A1RAB9ALMNAMEN1

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