SCHEMBL6762045

SCHEMBL6762045

C#Cc1ccccc1C#Cc1ccccc1C12CC3CC(CC(C3)C1)C2

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.33
LMNA P02545 1/20 0.33
GRIN2D O15399 1/20 0.32
GRIN3B O60391 1/20 0.32
GRIN1 Q05586 1/20 0.32
GRIN2A Q12879 1/20 0.32
GRIN2B Q13224 1/20 0.32
GRIN2C Q14957 1/20 0.32
GRIN3A Q8TCU5 1/20 0.32
KDM4E B2RXH2 2/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
HPGD P15428 1/20 0.31
HSD17B10 Q99714 1/20 0.31
HTT P42858 1/20 0.31
HSD11B1 P28845 1/20 0.31
POLB P06746 1/20 0.30
GAA P10253 1/20 0.30
GFER P55789 1/20 0.30

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
SCHEMBL6765076 0.88
SCHEMBL6762000 0.88
SCHEMBL6683930 0.82 ALDH1A1 (0.42) ALDH1A1LMNAGRIN2DGRIN3BGRIN1
SCHEMBL6770632 0.79
SCHEMBL6767076 0.79 ALDH1A1 (0.33) ALDH1A1LMNAKDM4EMEN1KMT2A
SCHEMBL7120428 0.76 ALDH1A1 (0.37) ALDH1A1LMNAGRIN2DGRIN3BGRIN1
SCHEMBL2747855 0.76 ALDH1A1 (0.36) ALDH1A1LMNAGRIN2DGRIN3BGRIN1
SCHEMBL6368525 0.76 GRIN2D (0.32) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL6764334 0.71 APP (0.32) ALDH1A1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL6765056 0.71 ALDH1A1 (0.38) ALDH1A1LMNAGRIN2DGRIN3BGRIN1

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-20040127715-A1 Adamantane compounds and insulating film forming coating solutions SUMITOMO CHEMICAL COMPANY, LIMITED 2004-07-01 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-20040127715-A1 Adamantane compounds and insulating film forming coating solutions CHRNA1, ANO1, CHRNA2 ALDH1A1 335/4885LMNA 1204/4885GRIN2D 624/4885

“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.