SCHEMBL2537604

SCHEMBL2537604

C=CC([SiH2]Cc1ccccc1)n1ccnc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP17A1 P05093 6/20 0.48
▸ CYP19A1 P11511 7/20 0.46
▸ CYP3A4 P08684 2/20 0.44
▸ MAPT P10636 2/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ POLB P06746 1/20 0.44
▸ CYP2D6 P10635 1/20 0.44
▸ CYP11B1 P15538 1/20 0.44
▸ CYP11B2 P19099 1/20 0.44
▸ TBXAS1 P24557 1/20 0.44
▸ QPCT Q16769 1/20 0.44
▸ CYP4Z1 Q86W10 1/20 0.44
▸ QPCTL Q9NXS2 1/20 0.44
▸ MEN1 O00255 1/20 0.39
▸ NR1I2 O75469 1/20 0.39
▸ USP2 O75604 1/20 0.39
▸ ABCB11 O95342 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ PLA2G1B P04054 1/20 0.39
▸ TP53 P04637 1/20 0.39

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
SCHEMBL27905027 0.76 CYP19A1 (0.57) CYP17A1CYP19A1CYP3A4MAPTCYP1A2
Hydrochloric Acid SCHEMBL2421272 0.75 CYP19A1 (0.56) CYP17A1CYP19A1CYP3A4MAPTCYP1A2
SCHEMBL28117945 0.72 CYP17A1 (0.49) CYP17A1CYP19A1CYP3A4MAPTCYP1A2
SCHEMBL2536677 0.71 CYP17A1 (0.53) CYP17A1CYP19A1CYP3A4MAPTCYP1A2
SCHEMBL1267769 0.69 CYP17A1 (0.82) CYP17A1CYP19A1CYP3A4MAPTCYP11B1
SCHEMBL27581291 0.69 CYP19A1 (0.60) CYP17A1CYP19A1CYP3A4MAPTCYP1A2
Hydrochloric Acid SCHEMBL28285792 0.68 CYP17A1 (0.80) CYP17A1CYP19A1CYP3A4MAPTCYP11B1
Bromide SCHEMBL28938866 0.68 CYP17A1 (0.80) CYP17A1CYP19A1CYP3A4MAPTCYP11B1
SCHEMBL6949625 0.66 CYP19A1 (0.60) CYP17A1CYP19A1CYP3A4MAPTCYP1A2
SCHEMBL27862767 0.66 CYP19A1 (0.60) CYP17A1CYP19A1CYP3A4MAPTCYP1A2

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-2334430-B1 METHOD FOR PREPARING A STRUCTURED POROUS MATERIAL COMPRISING NANOPARTICLES OF METAL 0 IMBEDDED IN THE WALLS THEREOF UNIV CLAUDE BERNARD LYON (FR) 2014-02-26 — — EP claimed
US-20110257006-A1 METHOD FOR PREPARING A STRUCTURED POROUS MATERIAL COMPRISING NANOPARTICLES OF METAL 0 IMBEDDED IN THE WALLS THEREOF UNIVERSITE CLAUDE BERNARD LYON I (FR) 2011-10-20 — — US claimed
US-20110257006-A1 METHOD FOR PREPARING A STRUCTURED POROUS MATERIAL COMPRISING NANOPARTICLES OF METAL 0 IMBEDDED IN THE WALLS THEREOF UNIVERSITE CLAUDE BERNARD LYON I (FR) 2011-10-20 — — US disclosed
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