SCHEMBL1974470

SCHEMBL1974470

COc1cc(-c2oc3ccc(CCCCCCCCCCCCCO)cc3c(=O)c2OC(C)=O)ccc1O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 2/20 0.46
KDM4E B2RXH2 4/20 0.46
ALDH1A1 P00352 4/20 0.46
MAPT P10636 3/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
TUBB4A P04350 1/20 0.46
TUBB P07437 1/20 0.46
TUBA3C P0DPH7 1/20 0.46
TUBA1B P68363 1/20 0.46
TUBA4A P68366 1/20 0.46
TUBB4B P68371 1/20 0.46
TUBB3 Q13509 1/20 0.46
TUBB2A Q13885 1/20 0.46
TUBB8 Q3ZCM7 1/20 0.46
TUBA3E Q6PEY2 1/20 0.46
TUBA1A Q71U36 1/20 0.46
TUBA1C Q9BQE3 1/20 0.46
TUBB6 Q9BUF5 1/20 0.46
TUBB2B Q9BVA1 1/20 0.46

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
SCHEMBL1976555 1.00 ABCG2 (0.46) ABCG2KDM4EALDH1A1MAPTNPC1
SCHEMBL1421976 0.92 TUBB4A (0.55) ABCG2KDM4EALDH1A1MAPTTUBB4A
SCHEMBL1421612 0.91 ABCG2 (0.44) ABCG2KDM4EALDH1A1MAPTTUBB4A
SCHEMBL1421412 0.91 ABCG2 (0.44) ABCG2KDM4EALDH1A1MAPTTUBB4A
SCHEMBL1421620 0.87 MAPT (0.58) ABCG2KDM4EALDH1A1MAPTCSNK2A2
SCHEMBL1421455 0.87 MAPT (0.58) ABCG2KDM4EALDH1A1MAPTCSNK2A2
SCHEMBL1421411 0.80 MAPT (0.65) ABCG2KDM4EALDH1A1MAPTTUBB4A
SCHEMBL1421641 0.79 MAPT (0.55) ABCG2KDM4EALDH1A1MAPTTUBB4A
SCHEMBL13660180 0.77 TUBB4A (0.60) ABCG2KDM4EALDH1A1MAPTTUBB4A
SCHEMBL2997729 0.75 CSNK2A2 (0.47) ABCG2KDM4EALDH1A1MAPTRAB9A

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-20110144194-A1 CHROMENONE DERIVATIVES USEFUL FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES AXOGLIA THERAPEUTICS (LU) 2011-06-16 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-20110144194-A1 CHROMENONE DERIVATIVES USEFUL FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES PARK7, CDR2, SNCA ABCG2 1767/4885KDM4E 2608/4885ALDH1A1 2339/4885

“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.