SCHEMBL18608262

SCHEMBL18608262

CC(C)(Cc1ccccc1)[Si](C)(C)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.50
TAAR1 Q96RJ0 1/20 0.50
LMNA P02545 1/20 0.47
CYP2D6 P10635 1/20 0.47
TRPA1 O75762 1/20 0.46
CYP2C9 P11712 2/20 0.43
CYP2C19 P33261 2/20 0.43
CYP1A2 P05177 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.41
HIF1A Q16665 1/20 0.41
ESR1 P03372 1/20 0.40
CYP3A4 P08684 2/20 0.40
ALDH1A1 P00352 1/20 0.40
FDPS P14324 1/20 0.39
KCNA5 P22460 1/20 0.38
MMP8 P22894 2/20 0.38
RECQL P46063 1/20 0.38
TP53 P04637 1/20 0.37
TSHR P16473 1/20 0.37
PPARG P37231 1/20 0.37

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
SCHEMBL15146119 0.88 TAAR1 (0.41) SLC6A2TAAR1LMNACYP2D6ESR1
SCHEMBL14447086 0.83 PTGS1 (0.57) SLC6A2LMNACYP2C19CYP1A2SMN1; SMN2
SCHEMBL12309927 0.83 ESR1 (0.61) SLC6A2LMNAESR1CYP3A4TSHR
SCHEMBL13809203 0.81 ESR1 (0.43) SLC6A2TAAR1HIF1AESR1CYP3A4
SCHEMBL13078449 0.81 ESR1 (0.43) TAAR1CYP1A2SMN1; SMN2ESR1ALDH1A1
SCHEMBL15457714 0.81 ESR1 (0.43) SLC6A2ESR1TSHRPPARGPPARA
SCHEMBL15443987 0.81 ESR1 (0.43) TAAR1TRPA1SMN1; SMN2ESR1ALDH1A1
SCHEMBL15443986 0.79 ESR1 (0.42) CYP2D6CYP1A2ESR1CYP3A4
SCHEMBL881459 0.79 ESR1 (0.42) TAAR1LMNAESR1ALDH1A1
SCHEMBL12224660 0.79 ESR1 (0.42) SLC6A2LMNATRPA1ESR1ALDH1A1

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-9828366-B2 Bicyclic derivatives and pharmaceutical composition including the same HANMI PHARM. CO., LTD. (KR) 2017-11-28 US disclosed
US-20170066750-A1 BICYCLIC DERIVATIVES AND PHARMACEUTICAL COMPOSITION INCLUDING THE SAME HANMI PHARM. CO., LTD. (KR) 2017-03-09 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-20170066750-A1 BICYCLIC DERIVATIVES AND PHARMACEUTICAL COMPOSITION INCLUDING THE SAME SLC5A1, SLC5A2, GPR119 SLC6A2 259/4885TAAR1 4466/4885LMNA 3235/4885

“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.