SCHEMBL6957758

SCHEMBL6957758

C[C](O[SiH](c1ccccc1)c1ccccc1)C(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.35
TAAR1 Q96RJ0 2/20 0.35
ALOX15 P16050 1/20 0.35
SLC6A2 P23975 1/20 0.35
TSHR P16473 3/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
CYP2C19 P33261 2/20 0.33
MAPK1 P28482 2/20 0.33
CYP3A4 P08684 2/20 0.33
CYP2C9 P11712 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
GAA P10253 1/20 0.33
PKM P14618 1/20 0.33
HSD11B1 P28845 1/20 0.32
HIF1A Q16665 1/20 0.32
LMNA P02545 1/20 0.31
HTT P42858 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
ELANE P08246 1/20 0.31

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
SCHEMBL7866609 0.75
SCHEMBL704481 0.75 SMN1; SMN2 (0.40) ALDH1A1TSHRCYP2C19SMN1; SMN2GAA
SCHEMBL7866600 0.74
SCHEMBL2711943 0.73 ALDH1A1 (0.43) ALDH1A1TSHRCYP3A4CYP2C9SMN1; SMN2
SCHEMBL272395 0.71 RIPK1 (0.35) ALDH1A1TAAR1ALOX15SLC6A2TSHR
SCHEMBL7057364 0.71 ELANE (0.43) ALDH1A1TSHRKMT2ASMN1; SMN2GAA
SCHEMBL272625 0.70 MAPK1 (0.37) ALDH1A1TAAR1ALOX15SLC6A2TSHR
SCHEMBL21065529 0.70 TSHR (0.42) ALDH1A1ALOX15TSHRCYP2C19CYP3A4
SCHEMBL4644892 0.70 ATM (0.39) ALDH1A1TSHRKMT2ACYP2C19MAPK1
SCHEMBL704189 0.70 MAPK1 (0.33) ALDH1A1TAAR1ALOX15SLC6A2MAPK1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0974582-B1 Process for the preparation of 4-substituted azetidinone derivatives TAKASAGO PERFUMERY CO LTD (JP) 2003-02-12 EP disclosed
US-6340751-B1 REACTION OF IMIDAZOLONE WITH AMIDE AND MAGNESIUM COMPOUND TAKASAGO INTERNATIONAL CORPORATION (JP) 2002-01-22 US disclosed
EP-0974582-A1 Process for the preparation of 4-substituted azetidinone derivatives Takasago International Corporation (JP) 2000-01-26 EP disclosed