SCHEMBL28451631

SCHEMBL28451631

CCc1ccc2c(c1)CC(C=O)=C2O[Si](C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.36
MAPT P10636 3/20 0.36
LMNA P02545 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
NPC1 O15118 1/20 0.36
MAPK1 P28482 1/20 0.36
RAB9A P51151 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
HPGD P15428 2/20 0.32
KDM4E B2RXH2 1/20 0.32
CYP1A2 P05177 1/20 0.32
POLB P06746 1/20 0.32
CYP2C19 P33261 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
GAA P10253 1/20 0.32
HTR2A P28223 1/20 0.30
HTR2C P28335 1/20 0.30
HTR2B P41595 1/20 0.30
PDK2 Q15119 1/20 0.30

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
SCHEMBL30477988 1.00 ALDH1A1 (0.36) ALDH1A1MAPTLMNASMN1; SMN2NPC1
SCHEMBL30477995 0.88 HTR2A (0.34) SMN1; SMN2NPC1MAPK1RAB9APOLB
SCHEMBL28447636 0.88 HTR2A (0.34) SMN1; SMN2NPC1MAPK1RAB9APOLB
SCHEMBL28451556 0.82 ALDH1A1 (0.41) ALDH1A1MAPTLMNASMN1; SMN2RAB9A
SCHEMBL30477977 0.82 ALDH1A1 (0.41) ALDH1A1MAPTLMNASMN1; SMN2RAB9A
SCHEMBL30477985 0.81 PARP1 (0.35) CYP1A2HTR2B
SCHEMBL28897519 0.81 HSP90AA1 (0.39) MAPTSMN1; SMN2NPC1RAB9AHTR2B
SCHEMBL30477987 0.81 HSP90AA1 (0.39) MAPTSMN1; SMN2NPC1RAB9AHTR2B
SCHEMBL28453681 0.81 METAP1 (0.39) ALDH1A1MAPTLMNAL3MBTL1TDP1
SCHEMBL30477983 0.81 METAP1 (0.39) ALDH1A1MAPTLMNAL3MBTL1TDP1

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-111533764-B Method for preparing siloxyindene derivative by utilizing domino reaction 杭州师范大学 2023-06-06 CN disclosed
CN-111533764-A Method for preparing siloxyindene derivative by using domino reaction 杭州师范大学 2020-08-14 CN disclosed