SCHEMBL19344972

SCHEMBL19344972

C[Si]1(C)c2ccccc2N(c2ccc(C#N)c(-c3cc(N4c5ccccc5[Si](C)(C)c5ccccc54)ccc3C#N)c2)c2ccccc21

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.35
HPGD P15428 2/20 0.35
LMNA P02545 1/20 0.35
MAPK1 P28482 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HTR2A P28223 1/20 0.34
HTR6 P50406 1/20 0.34
KDM4E B2RXH2 3/20 0.33
AR P10275 3/20 0.33
GAA P10253 2/20 0.33
GLA P06280 1/20 0.33
GALR3 O60755 1/20 0.33
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
FNTA P49354 1/20 0.31
FNTB P49356 1/20 0.31
PGGT1B P53609 1/20 0.31

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
SCHEMBL19345010 0.88 ALDH1A1 (0.35) ALDH1A1HPGDLMNAMAPK1SMN1; SMN2
SCHEMBL21397028 0.86 GRIA1 (0.34) ALDH1A1HPGDLMNAMAPK1SMN1; SMN2
SCHEMBL19344968 0.86 ALDH1A1 (0.34) ALDH1A1HPGDLMNAMAPK1SMN1; SMN2
SCHEMBL21396938 0.83 RET (0.35)
SCHEMBL19345073 0.83 PGR (0.35) ALDH1A1HPGDLMNAMAPK1SMN1; SMN2
SCHEMBL19340288 0.82 ALDH1A1 (0.35) ALDH1A1HPGDLMNAMAPK1SMN1; SMN2
SCHEMBL19765432 0.80 MEN1 (0.34) ALDH1A1LMNASMN1; SMN2GAA
SCHEMBL19344945 0.78 TSHR (0.42) ALDH1A1ARMAOAMAOB
SCHEMBL19345084 0.77 TSHR (0.36) ARMAOAMAOB
SCHEMBL19344994 0.77 PGR (0.43) AR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170263871-A1 ORGANIC ELECTROLUMINESCENT MATERIAL AND ORGANIC OPTOELECTRONIC DEVICE TIANMA MICRO-ELECTRONICS CO., LTD. (CN) 2017-09-14 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-20170263871-A1 ORGANIC ELECTROLUMINESCENT MATERIAL AND ORGANIC OPTOELECTRONIC DEVICE OR10J3, RPS10, OR51E2 ALDH1A1 616/4885HPGD 3757/4885LMNA 1723/4885

“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.