SCHEMBL13754055

SCHEMBL13754055

C=CC(O[Si](CC)(CC)CC)c1ccc(C(F)(F)F)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE2A O00408 2/20 0.37
▸ RPS6KB1 P23443 2/20 0.33
▸ MC4R P32245 1/20 0.33
▸ TEAD1 P28347 3/20 0.32
▸ CYP3A4 P08684 2/20 0.32
▸ FLT3 P36888 1/20 0.32
▸ PRKCD Q05655 1/20 0.32
▸ CAMK2B Q13554 1/20 0.32
▸ CAMK2G Q13555 1/20 0.32
▸ CAMK2D Q13557 1/20 0.32
▸ CYP19A1 P11511 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ TP53 P04637 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ ALOX15 P16050 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ NOS3 P29474 1/20 0.32
▸ NOS1 P29475 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32

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
SCHEMBL5314916 0.82 CHRNA7 (0.31) —
SCHEMBL5317775 0.80 LMNA (0.34) CYP3A4ALDH1A1LMNATP53ALOX15
SCHEMBL5315971 0.79 ALDH1A1 (0.40) CYP3A4ALDH1A1TP53CYP1A2ALOX15
SCHEMBL25025738 0.78 PDE2A (0.39) PDE2ATEAD1CES2CES1
SCHEMBL5314215 0.73 UGT2B7 (0.40) CYP3A4CYP1A2
SCHEMBL29126636 0.71 TEAD1 (0.44) TEAD1NPSR1CES2CES1
SCHEMBL28908107 0.71 EEF2K (0.33) LMNA
SCHEMBL3300767 0.68 SLC7A5 (0.57) CYP3A4ALDH1A1LMNATP53CYP1A2
SCHEMBL31507937 0.67 CCNE2 (0.30) LMNA
SCHEMBL5313188 0.67 ESR1 (0.39) CYP3A4CYP19A1LMNACYP2C19BLM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8314246-B2 Catalytic reactions involving alkenes MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2012-11-20 — — US disclosed
US-20090216025-A1 Catalytic reactions involving alkenes MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2009-08-27 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090216025-A1 Catalytic reactions involving alkenes ADH5, ADH1C, ADH1A PDE2A 4789/4885RPS6KB1 4498/4885MC4R 4680/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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