SCHEMBL9563556

SCHEMBL9563556

C=C[Si](C)(CCCCCCCl)c1cccc(C(F)(F)F)c1

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.33
GAA P10253 1/20 0.33
ATM Q13315 1/20 0.33
NPSR1 Q6W5P4 1/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32
HTR2B P41595 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
NFE2L2 Q16236 1/20 0.31
PNMT P11086 1/20 0.31
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31
POLB P06746 2/20 0.31
TAAR1 Q96RJ0 1/20 0.31
TP53BP1 Q12888 1/20 0.30
THRB P10828 1/20 0.30
BRD4 O60885 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
SCHEMBL9563602 1.00 ALDH1A1 (0.33) ALDH1A1GAAATMNPSR1L3MBTL1
SCHEMBL9563555 1.00 ALDH1A1 (0.33) ALDH1A1GAAATMNPSR1L3MBTL1
SCHEMBL9563619 0.99 ALDH1A1 (0.34) ALDH1A1GAAATMNPSR1L3MBTL1
SCHEMBL9563591 0.85 NR1H2 (0.36) HDAC1HDAC6
SCHEMBL9563595 0.85 NR1H2 (0.36) HDAC1HDAC6
SCHEMBL9563519 0.85 NR1H2 (0.36) HDAC1HDAC6
SCHEMBL9563568 0.84 NR1H2 (0.36) L3MBTL1
SCHEMBL9563549 0.84 HTR2A (0.36) ALDH1A1GAAATMNPSR1HTR2A
SCHEMBL9563548 0.78 LMNA (0.39) ALDH1A1GAA
SCHEMBL9563534 0.78 LMNA (0.39) ALDH1A1GAA

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
EP-0524829-A1 Novel silane compound, process of preparing the same and plant growth regulator containing the same SHIN-ETSU CHEMICAL CO., LTD. (JP) 1993-01-27 EP disclosed