SCHEMBL9716601

SCHEMBL9716601

CO[Si](OC)(C(C)c1ccccc1)C(C)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.39
TAAR1 Q96RJ0 3/20 0.38
ALDH1A1 P00352 3/20 0.37
THRB P10828 1/20 0.37
ADRA2A P08913 2/20 0.37
CYP2D6 P10635 2/20 0.37
LMNA P02545 2/20 0.37
ADRA2C P18825 1/20 0.37
HIF1A Q16665 1/20 0.37
KDM4E B2RXH2 1/20 0.37
CHRM2 P08172 2/20 0.36
CHRM1 P11229 2/20 0.36
ADRA1A P35348 2/20 0.36
SLC6A3 Q01959 2/20 0.36
KCNH2 Q12809 2/20 0.36
CYP3A4 P08684 2/20 0.36
HTR1A P08908 1/20 0.36
ADORA3 P0DMS8 1/20 0.36
SMPD1 P17405 1/20 0.36
DRD1 P21728 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
SCHEMBL140535 0.81 TRPA1 (0.39) KMT2ATAAR1ALDH1A1THRBADRA2A
SCHEMBL6890013 0.79 FAAH (0.38) KMT2ATAAR1ALDH1A1THRBADRA2A
SCHEMBL3084097 0.79 FAAH (0.38) KMT2ATAAR1ALDH1A1THRBADRA2A
SCHEMBL9716562 0.76 TAAR1 (0.39) TAAR1ALDH1A1LMNACYP3A4CYP1A2
SCHEMBL8760763 0.74 TSHR (0.44) KMT2AALDH1A1THRBCYP2D6SLC6A3
SCHEMBL19809205 0.74 KMT2A (0.42) KMT2AALDH1A1ADRA2ACYP2D6LMNA
SCHEMBL9716573 0.74 TAAR1 (0.38) KMT2ATAAR1LMNACASRTRPA1
SCHEMBL6420857 0.72 TAAR1 (0.42) TAAR1ALDH1A1ADRA2ACYP2D6LMNA
SCHEMBL25799302 0.72 TAAR1 (0.42) TAAR1ALDH1A1ADRA2ACYP2D6LMNA
SCHEMBL9716583 0.71 LMNA (0.43) KMT2ATAAR1LMNACYP3A4TRPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0282341-B1 PROCESS FOR POLYMERIZATION OF OLEFINS AND POLYMERIZATION CATALYST MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1992-05-20 EP disclosed
EP-0455313-A1 Process for polymerization of olefins and polymerization catalyst MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1991-11-06 EP disclosed
US-5028671-A Using coordination catalyst contining magnesium, titanium, halogen compounds with organoaluminum and organosilicon compounds MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1991-07-02 US disclosed
EP-0282341-A1 Process for polymerization of olefins and polymerization catalyst MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1988-09-14 EP disclosed