SCHEMBL8894560

SCHEMBL8894560

CCOC(=O)[CH]Nc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.53
CYP1A2 P05177 1/20 0.52
CYP2C19 P33261 1/20 0.52
MAPT P10636 8/20 0.50
TDP1 Q9NUW8 1/20 0.50
LMNA P02545 4/20 0.48
DHODH Q02127 3/20 0.48
MAPK1 P28482 2/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
ALDH1A1 P00352 2/20 0.48
RAB9A P51151 2/20 0.48
THRB P10828 1/20 0.48
HSD17B10 Q99714 1/20 0.46
MDM2 Q00987 2/20 0.46
MDM4 O15151 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.45
TSHR P16473 1/20 0.44
NPC1 O15118 1/20 0.44
HPGD P15428 1/20 0.44

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
SCHEMBL1022553 0.83 RAB9A (0.59) GAACYP1A2CYP2C19MAPTTDP1
SCHEMBL1022149 0.83 RAB9A (0.59) GAACYP1A2CYP2C19MAPTTDP1
SCHEMBL14311838 0.81 RAB9A (0.59) GAACYP1A2CYP2C19MAPTLMNA
SCHEMBL395324 0.76 DHODH (0.77) GAACYP1A2CYP2C19MAPTTDP1
SCHEMBL8964150 0.75 CYP1A2 (0.63) GAACYP1A2CYP2C19MAPTTDP1
SCHEMBL19339180 0.75 CYP1A2 (0.63) GAACYP1A2CYP2C19MAPTTDP1
SCHEMBL1717228 0.75 MAPT (0.51) GAAMAPTTDP1LMNAMAPK1
SCHEMBL10877147 0.75 MAPT (0.79) MAPTLMNAMEN1KMT2AALDH1A1
SCHEMBL1974848 0.75 MAPT (0.51) GAAMAPTTDP1LMNAMAPK1
SCHEMBL14059066 0.75 MAPT (0.52) GAACYP1A2CYP2C19MAPTTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5670563-A ORGANOTIN COMPOUND, PHOSPHORUS COMPOUND CIBA-SPECIALTY CHEMICALS CORPORATION (US) 1997-09-23 US disclosed