SCHEMBL3466848

SCHEMBL3466848

COCCNc1nccn2c(-c3ccccc3F)cnc12

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 4/20 0.43
TTK P33981 10/20 0.42
ALDH1A1 P00352 2/20 0.41
CYP1A2 P05177 2/20 0.41
CYP3A4 P08684 2/20 0.41
LMNA P02545 1/20 0.41
CYP2C19 P33261 1/20 0.41
KCNN4 O15554 1/20 0.40
IDO1 P14902 1/20 0.39
UTS2R Q9UKP6 1/20 0.38
LDHA P00338 1/20 0.38
USP2 O75604 1/20 0.37
CYP2D6 P10635 1/20 0.37
ALOX15 P16050 1/20 0.37
HSD17B10 Q99714 1/20 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
SCHEMBL5401154 0.81 FLT3 (0.54) FLT3TTKIDO1
SCHEMBL3466360 0.77 TTK (0.53) FLT3TTKALDH1A1LMNA
SCHEMBL3470355 0.76 CYP1A2 (0.53) FLT3TTKALDH1A1CYP1A2CYP3A4
SCHEMBL3466464 0.76 TTK (0.48) FLT3TTK
SCHEMBL3467192 0.76 TTK (0.56) FLT3TTKALDH1A1CYP1A2CYP3A4
SCHEMBL8240004 0.76 FLT3 (0.40) FLT3TTKCYP3A4LMNAUTS2R
SCHEMBL3470277 0.75 FYN (0.54) FLT3TTK
SCHEMBL8246959 0.74 AURKA (0.54) FLT3TTK
SCHEMBL3467735 0.72 PGK1 (0.47) FLT3TTKALDH1A1CYP1A2CYP3A4
SCHEMBL5401149 0.71 CCNE2 (0.41) FLT3IDO1

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
WO-2010069684-A1 COMPOUNDS FOR TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY BIOMARIN IGA, LTD. (BS) 2010-06-24 WO claimed
WO-2010069684-A1 COMPOUNDS FOR TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY BIOMARIN IGA, LTD. (BS) 2010-06-24 WO disclosed