SCHEMBL279350

SCHEMBL279350

C=C(/N=C/c1cc(Cl)ccc1Oc1ccc(C#N)cc1)O[Si](C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TBXA2R P21731 3/20 0.36
CCR5 P51681 1/20 0.35
HTT P42858 1/20 0.35
HPGD P15428 2/20 0.34
TSHR P16473 2/20 0.34
AR P10275 1/20 0.34
MERTK Q12866 1/20 0.34
CYP19A1 P11511 1/20 0.34
SLC6A4 P31645 4/20 0.33
KCNH2 Q12809 3/20 0.33
SLC6A3 Q01959 1/20 0.33
HTR2A P28223 2/20 0.33
CYP11B1 P15538 2/20 0.32
CYP11B2 P19099 2/20 0.32
FFAR1 O14842 1/20 0.32
MAPT P10636 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
SCHEMBL278967 0.87 TBXA2R (0.38) TBXA2RARSLC6A4CYP11B1
SCHEMBL275612 0.87 TBXA2R (0.38) TBXA2RARSLC6A4CYP11B1
SCHEMBL279205 0.87 TBXA2R (0.36) TBXA2RARSLC6A4CYP11B1CYP11B2
SCHEMBL279032 0.84 SLC6A4 (0.45) HTTHPGDTSHRSLC6A4KCNH2
SCHEMBL279345 0.83 SLC6A4 (0.38) HTTHPGDTSHRSLC6A4KCNH2
SCHEMBL278999 0.81 ALDH1A1 (0.39) MAPT
SCHEMBL279212 0.81 MEN1 (0.39) TBXA2RCCR5HTTHPGDMAPT
SCHEMBL279201 0.79 HPGD (0.37) HTTHPGDTSHRMAPT
SCHEMBL7841968 0.79 KMT2A (0.42) HPGDTSHRMAPT
SCHEMBL279114 0.76 CCR5 (0.42) CCR5HPGDTSHRARCYP19A1

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-8134001-B2 Spiroindolinone derivatives HOFFMANN-LA ROCHE INC. (US) 2012-03-13 US disclosed
US-20090156610-A1 Spiroindolinone Derivatives DING QINGJIE 2009-06-18 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-20090156610-A1 Spiroindolinone Derivatives SDHA, AR, XPOT TBXA2R 236/4885CCR5 2331/4885HTT 2366/4885

“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.