SCHEMBL13309803

SCHEMBL13309803

CCCCCCCCNc1cc(C)nc(-c2csc(C)n2)n1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DNM2 P50570 9/20 0.49
▸ TLR8 Q9NR97 1/20 0.48
▸ ALDH1A1 P00352 5/20 0.41
▸ LMNA P02545 2/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ TP53 P04637 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ RAB9A P51151 2/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ STAT1 P42224 1/20 0.40
▸ HPGD P15428 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ FLT3 P36888 1/20 0.39
▸ TYRO3 Q06418 1/20 0.39
▸ MERTK Q12866 1/20 0.39

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
SCHEMBL13309851 1.00 DNM2 (0.49) DNM2TLR8ALDH1A1LMNASMN1; SMN2
SCHEMBL13309820 1.00 DNM2 (0.49) DNM2TLR8ALDH1A1LMNASMN1; SMN2
SCHEMBL13309838 1.00 DNM2 (0.49) DNM2TLR8ALDH1A1LMNASMN1; SMN2
SCHEMBL13309871 1.00 DNM2 (0.49) DNM2TLR8ALDH1A1LMNASMN1; SMN2
SCHEMBL13309898 0.80 PFKFB3 (0.46) DNM2TLR8ALDH1A1LMNASMN1; SMN2
SCHEMBL13309831 0.76 LATS1 (0.52) DNM2TLR8ALDH1A1LMNASMN1; SMN2
SCHEMBL13309843 0.76 LATS1 (0.52) DNM2TLR8ALDH1A1LMNASMN1; SMN2
SCHEMBL13309859 0.76 LATS1 (0.52) DNM2TLR8ALDH1A1LMNASMN1; SMN2
SCHEMBL13309815 0.76 LATS1 (0.52) DNM2TLR8ALDH1A1LMNASMN1; SMN2
SCHEMBL13309794 0.76 DNM2 (0.48) DNM2TLR8ALDH1A1LMNASMN1; SMN2

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-7731985-B2 4-aminopyrimidines and their use for the antimicrobial treatment of surfaces CIBA SPECIALTY CHEMICALS CORPORATION (US) 2010-06-08 — — US disclosed
US-7731985-B2 4-aminopyrimidines and their use for the antimicrobial treatment of surfaces CIBA SPECIALTY CHEMICALS CORPORATION (US) 2010-06-08 — — US disclosed
Send feedback