SCHEMBL28899345

SCHEMBL28899345

C[Si](Oc1ccc(N)cc1)(O[Si](C)(Oc1ccc(N)cc1)c1ccccc1)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.45
RAB9A P51151 6/20 0.39
MAPT P10636 6/20 0.39
SMN1; SMN2 Q16637 4/20 0.39
GAA P10253 2/20 0.39
MAOB P27338 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
TDP1 Q9NUW8 6/20 0.39
MAPK1 P28482 1/20 0.39
KDM1A O60341 1/20 0.39
NPC1 O15118 5/20 0.38
MEN1 O00255 5/20 0.38
KMT2A Q03164 5/20 0.38
NLRP3 Q96P20 1/20 0.38
ALDH1A1 P00352 7/20 0.38
CYP3A4 P08684 3/20 0.38
TSHR P16473 3/20 0.37
APAF1 O14727 1/20 0.36
NCOA1 Q15788 1/20 0.36
NCOA3 Q9Y6Q9 1/20 0.36

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
SCHEMBL13949334 0.92 MAOA (0.48) MAOARAB9AMAPTSMN1; SMN2GAA
SCHEMBL28665119 0.81 MAOA (0.48) MAOARAB9AMAPTSMN1; SMN2GAA
SCHEMBL28440907 0.81 MAOA (0.48) MAOARAB9AMAPTSMN1; SMN2GAA
SCHEMBL707283 0.78 CA4 (0.42) MAOARAB9AMAPTNPC1KMT2A
SCHEMBL3054931 0.76 MAOA (0.52) MAOARAB9AMAPTSMN1; SMN2GAA
SCHEMBL28444685 0.76 MAOA (0.52) MAOARAB9AMAPTSMN1; SMN2GAA
SCHEMBL28454135 0.74 TDP1 (0.47) MAOARAB9AMAPTSMN1; SMN2GAA
SCHEMBL28442169 0.74 KDM1A (0.46) MAOARAB9AMAPTSMN1; SMN2GAA
SCHEMBL705002 0.73 CA4 (0.42) MAOARAB9AMAPTNPC1KMT2A
SCHEMBL7424773 0.73 MAOA (0.44) MAOARAB9AMAPTSMN1; SMN2GAA

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
CN-111704719-A Thermosetting polyimide resin, prepolymer, preparation method and application 中国科学院化学研究所 2020-09-25 CN claimed
CN-111704719-A Thermosetting polyimide resin, prepolymer, preparation method and application 中国科学院化学研究所 2020-09-25 CN disclosed