SCHEMBL9013667

SCHEMBL9013667

CO[Si](CC(CNCc1ccccc1)C(C)N)(OC)OC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 2/20 0.42
BCHE P06276 3/20 0.40
MCHR1 Q99705 1/20 0.40
CYP2D6 P10635 2/20 0.39
ALDH1A1 P00352 1/20 0.39
CYP1A2 P05177 1/20 0.39
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
OPRD1 P41143 1/20 0.36
OPRK1 P41145 1/20 0.36
ERAP2 Q6P179 1/20 0.35
ATM Q13315 1/20 0.35
SLC6A2 P23975 2/20 0.35
TAAR1 Q96RJ0 2/20 0.35
SIGMAR1 Q99720 2/20 0.35
MAOA P21397 1/20 0.35
SLC6A4 P31645 1/20 0.35
SLC6A3 Q01959 1/20 0.35
CYP2A6 P11509 1/20 0.35

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
SCHEMBL9013666 0.76 ANPEP (0.38) ANPEPBCHEMCHR1CYP2D6ALDH1A1
SCHEMBL29112896 0.75
SCHEMBL28997123 0.73 ANPEP (0.39) ANPEPBCHEMCHR1CYP2D6ALDH1A1
SCHEMBL3112742 0.72 ANPEP (0.56) ANPEPBCHECYP2D6ALDH1A1CYP1A2
SCHEMBL19146819 0.72 ANPEP (0.56) ANPEPBCHECYP2D6ALDH1A1CYP1A2
SCHEMBL16714786 0.72 SIGMAR1 (0.58) BCHECYP2D6ALDH1A1MEN1KMT2A
SCHEMBL15360482 0.71 MEN1 (0.50) BCHEALDH1A1MEN1KMT2ATDP1
Ammonia Solution, Strong SCHEMBL20237223 0.71 ANPEP (0.54) ANPEPBCHECYP2D6ALDH1A1CYP1A2
SCHEMBL28427317 0.70 MEN1 (0.43) BCHEMEN1KMT2ATDP1ATM
SCHEMBL749839 0.70 BCHE (0.49) ANPEPBCHEMCHR1CYP2D6ALDH1A1

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-5527594-A HEAT RESISTANCE, DURABILITY; OPTICAL RECORDING MEDIA DIAFOIL HOECHST COMPANY, LIMITED (JP) 1996-06-18 US disclosed
EP-0545371-A1 Optical tape DIAFOIL HOECHST CO., LTD (JP) 1993-06-09 EP disclosed