SCHEMBL13845321

SCHEMBL13845321

CCCOc1ccc(C=C(C)[SiH](C)C)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
PTGS1 P23219 1/20 0.48
PTGS2 P35354 1/20 0.48
LTA4H P09960 1/20 0.46
ABCG2 Q9UNQ0 1/20 0.43
TUBB4A P04350 1/20 0.43
TUBB P07437 1/20 0.43
TUBA3C P0DPH7 1/20 0.43
TUBA1B P68363 1/20 0.43
TUBA4A P68366 1/20 0.43
TUBB4B P68371 1/20 0.43
TUBB3 Q13509 1/20 0.43
TUBB2A Q13885 1/20 0.43
TUBB8 Q3ZCM7 1/20 0.43
TUBA3E Q6PEY2 1/20 0.43
TUBA1A Q71U36 1/20 0.43
TUBA1C Q9BQE3 1/20 0.43
TUBB6 Q9BUF5 1/20 0.43
TUBB2B Q9BVA1 1/20 0.43

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
SCHEMBL17080933 0.77 MEN1 (0.59) MEN1KMT2APTGS1PTGS2LTA4H
SCHEMBL8865062 0.75 AKR1C3 (0.53) MEN1KMT2APTGS1PTGS2LTA4H
SCHEMBL8865077 0.75 AKR1C3 (0.53) MEN1KMT2APTGS1PTGS2LTA4H
SCHEMBL6333082 0.75 MEN1 (0.60) MEN1KMT2APTGS1PTGS2LTA4H
SCHEMBL6333085 0.75 MEN1 (0.60) MEN1KMT2APTGS1PTGS2LTA4H
SCHEMBL5248593 0.74 MEN1 (0.63) MEN1KMT2APTGS1PTGS2LTA4H
SCHEMBL9546916 0.74 PTGS1 (0.69) MEN1KMT2APTGS1PTGS2LTA4H
SCHEMBL9624989 0.73 MEN1 (0.54) MEN1KMT2APTGS1PTGS2LTA4H
1,4-Dipropoxybenzene SCHEMBL122039 0.73 LTA4H (0.67) MEN1KMT2ALTA4HCYP2C9L3MBTL1
SCHEMBL3195187 0.72 MEN1 (0.61) MEN1KMT2APTGS1PTGS2LTA4H

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-7534547-B2 Optically active compound and photosensitive resin composition OSAKA GAS COMPANY LIMITED (JP) 2009-05-19 US disclosed