SCHEMBL9375835

SCHEMBL9375835

CCP(=O)(CC)OCc1ccccn1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FDPS P14324 2/20 0.47
SMN1; SMN2 Q16637 3/20 0.45
NPC1 O15118 1/20 0.45
LMNA P02545 1/20 0.45
RAB9A P51151 1/20 0.45
PARP10 Q53GL7 1/20 0.45
ALDH1A1 P00352 3/20 0.45
KDM4E B2RXH2 2/20 0.44
KCNA5 P22460 1/20 0.42
HSD17B10 Q99714 2/20 0.42
HPGD P15428 1/20 0.42
ALOX15 P16050 1/20 0.42

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
SCHEMBL2956244 0.83 CA12 (0.45) FDPSLMNAALDH1A1KCNA5HSD17B10
SCHEMBL707791 0.82 TSHR (0.47) FDPSSMN1; SMN2NPC1LMNARAB9A
SCHEMBL27563232 0.78 HRH3 (0.46) FDPSLMNAALDH1A1KDM4EKCNA5
SCHEMBL23884931 0.77 FDPS (0.53) FDPSSMN1; SMN2NPC1LMNARAB9A
SCHEMBL10700245 0.77 FDPS (0.53) FDPSSMN1; SMN2NPC1LMNARAB9A
SCHEMBL18235430 0.76 ALDH1A1 (0.50) FDPSSMN1; SMN2NPC1LMNARAB9A
SCHEMBL11528070 0.76 ALDH1A1 (0.57) FDPSSMN1; SMN2NPC1LMNARAB9A
SCHEMBL16974746 0.76 ALDH1A1 (0.57) FDPSSMN1; SMN2NPC1LMNARAB9A
SCHEMBL11952596 0.76 FDPS (0.47) FDPSSMN1; SMN2NPC1LMNARAB9A
SCHEMBL16974747 0.75 ALDH1A1 (0.56) FDPSSMN1; SMN2NPC1LMNARAB9A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0588785-A1 UREA BASED LIPOXYGENASE INHIBITING COMPOUNDS ABBOTT LABORATORIES (US) 1994-03-30 EP disclosed
US-5185363-A Administering for treatment of inflammatory diseases ABBOTT LABORATORIES (US) 1993-02-09 US disclosed
EP-0588785-A4 UREA BASED LIPOXYGENASE INHIBITING COMPOUNDS. ABBOTT LAB (US) 1991-12-30 EP disclosed
WO-1990012008-A1 UREA BASED LIPOXYGENASE INHIBITING COMPOUNDS ABBOTT LABORATORIES (US) 1990-10-18 WO disclosed