SCHEMBL12024541

SCHEMBL12024541

CCOC(=O)Cc1c([Si](CC)(CC)CC)[nH]c2ncccc12

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.47
▸ KDM4E B2RXH2 2/20 0.47
▸ KLK6 Q92876 1/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ HSD17B10 Q99714 3/20 0.41
▸ MAPK1 P28482 3/20 0.41
▸ USP2 O75604 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ PKM P14618 1/20 0.40
▸ MAPT P10636 3/20 0.40
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ TP53 P04637 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL12024540 0.79 KDM4E (0.44) LMNAKDM4EKLK6SMN1; SMN2ALDH1A1
SCHEMBL3921386 0.76 HTT (0.39) KDM4ESMN1; SMN2ALDH1A1TSHRPKM
SCHEMBL1939157 0.75 KLK6 (0.54) LMNAKDM4EKLK6SMN1; SMN2ALDH1A1
SCHEMBL368035 0.73 PKM (0.63) LMNAKDM4ESMN1; SMN2ALDH1A1MAPK1
SCHEMBL1940624 0.73 EGFR (0.45) LMNAKDM4EKLK6SMN1; SMN2ALDH1A1
SCHEMBL9535451 0.72 MEN1 (0.59) KDM4ESMN1; SMN2ALDH1A1HSD17B10TSHR
SCHEMBL3380080 0.70 HSD17B10 (0.65) LMNAKDM4ESMN1; SMN2ALDH1A1HSD17B10
SCHEMBL29419554 0.70 SMN1; SMN2 (0.49) LMNAKDM4ESMN1; SMN2ALDH1A1HSD17B10
SCHEMBL16464368 0.69 ALDH1A1 (0.48) LMNAKDM4EALDH1A1HSD17B10TSHR
SCHEMBL16464155 0.69 HTR6 (0.51) KDM4ESMN1; SMN2ALDH1A1HSD17B10TSHR

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-20110301168-A1 CYCLOALKANE[B]AZAINDOLE ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS AMIRA PHARMACEUTICALS, INC. (US) 2011-12-08 — — 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-20110301168-A1 CYCLOALKANE[B]AZAINDOLE ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS PTGDR, PTGDR2, PTGER2 LMNA 3021/4885KDM4E 4697/4885KLK6 4276/4885

“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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