SCHEMBL18905500

SCHEMBL18905500

CC(C)(O)c1ccc(OCCC[SiH3])cc1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 7/20 0.56
SMN1; SMN2 Q16637 3/20 0.45
CYP3A4 P08684 1/20 0.45
PSMB1 P20618 1/20 0.44
PSMB5 P28074 1/20 0.44
PSMB2 P49721 1/20 0.44
ALDH1A1 P00352 3/20 0.40
KDM4E B2RXH2 3/20 0.40
MEN1 O00255 1/20 0.40
HTT P42858 1/20 0.40
KMT2A Q03164 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
MAOB P27338 2/20 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
SCHEMBL24533728 0.86 HRH3 (0.61) HRH3SMN1; SMN2CYP3A4PSMB1PSMB5
SCHEMBL9476152 0.85 HRH3 (0.59) HRH3SMN1; SMN2CYP3A4ALDH1A1
SCHEMBL18905485 0.84 ALDH1A1 (0.46) HRH3SMN1; SMN2CYP3A4PSMB1PSMB5
SCHEMBL18905502 0.83 ALDH1A1 (0.54) HRH3SMN1; SMN2CYP3A4PSMB1PSMB5
SCHEMBL18905283 0.82 HRH3 (0.49) HRH3SMN1; SMN2CYP3A4PSMB1PSMB5
SCHEMBL21483751 0.81 HRH3 (0.56) HRH3SMN1; SMN2CYP3A4PSMB1PSMB5
SCHEMBL24533712 0.81 HRH3 (0.55) HRH3SMN1; SMN2CYP3A4PSMB1PSMB5
SCHEMBL19687568 0.81 SMN1; SMN2 (0.66) HRH3SMN1; SMN2CYP3A4PSMB1PSMB5
SCHEMBL18905488 0.80 KDM4E (0.41) HRH3SMN1; SMN2CYP3A4PSMB1PSMB5
SCHEMBL25575420 0.77 HRH3 (0.52) HRH3ALDH1A1MAOB

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-20170154766-A1 SILICON-CONTAINING CONDENSATE, COMPOSITION FOR FORMING A SILICON-CONTAINING RESIST UNDER LAYER FILM, AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2017-06-01 US disclosed