SCHEMBL4137217

SCHEMBL4137217

Cc1ccc(-c2ccc3cc([Si](C)(C)C)ccc3n2)c(C)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.42
BACE1 P56817 2/20 0.40
NCK1 P16333 1/20 0.40
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
AR P10275 2/20 0.37
MAPT P10636 5/20 0.37
ALDH1A1 P00352 3/20 0.37
NPC1 O15118 3/20 0.37
RAB9A P51151 2/20 0.37
KDM4E B2RXH2 2/20 0.37
HPGD P15428 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
NPSR1 Q6W5P4 1/20 0.36
ALPL P05186 2/20 0.35
CA9 Q16790 1/20 0.35
LMNA P02545 3/20 0.35
TSHR P16473 1/20 0.35
HSD17B10 Q99714 1/20 0.35
MEN1 O00255 2/20 0.35

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
SCHEMBL13298969 0.87 CYP1A2 (0.55) CYP1A2BACE1NCK1MAOAMAOB
SCHEMBL28264355 0.83 CTSD (0.47) CYP1A2BACE1MAOAMAOBAR
SCHEMBL28264353 0.80 ESR1 (0.49) CYP1A2BACE1NCK1MAOAMAOB
SCHEMBL13870906 0.79 CYP1A2 (0.41) CYP1A2BACE1NCK1ARMAPT
SCHEMBL13989405 0.79 CYP1A2 (0.53) CYP1A2ARMAPTALDH1A1NPC1
SCHEMBL14500748 0.78 NCF1 (0.50) CYP1A2BACE1NCK1MAOAMAOB
SCHEMBL18774770 0.78 AR (0.57) CYP1A2ARMAPTALDH1A1NPC1
SCHEMBL15831600 0.77 CCR1 (0.50) CYP1A2BACE1NCK1ALDH1A1KDM4E
SCHEMBL15831576 0.77 CYP1A2 (0.36) CYP1A2BACE1NCK1AR
SCHEMBL4134580 0.76 CYP1A2 (0.50) CYP1A2BACE1NCK1MAOAMAOB

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-8071226-B2 Red phosphorescent compounds and organic electroluminescent devices using the same SFC Co. Ltd (KR) 2011-12-06 US disclosed
US-20090104472-A1 RED PHOSPHORESCENT COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICES USING THE SAME SFC CO., LTD 2009-04-23 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-20090104472-A1 RED PHOSPHORESCENT COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICES USING THE SAME TRPC1, IK, EYA2 CYP1A2 3421/4885BACE1 3542/4885NCK1 1033/4885

“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.