SCHEMBL5740990

SCHEMBL5740990

CCC1(CC)CCCC(=O)C1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TRIM24 O15164 2/20 0.33
TRIM33 Q9UPN9 2/20 0.33
KDM4E B2RXH2 1/20 0.32
LMNA P02545 1/20 0.32
CYP2C19 P33261 1/20 0.32
ALDH1A1 P00352 1/20 0.32
TSHR P16473 1/20 0.30
NPSR1 Q6W5P4 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
SCHEMBL27070172 0.86 KDM4E (0.34) KDM4ELMNACYP2C19TSHRNPSR1
SCHEMBL9458907 0.83 ALDH1A1 (0.42) LMNACYP2C19ALDH1A1TSHR
SCHEMBL11624004 0.80 NPC1 (0.32) ALDH1A1
SCHEMBL7042305 0.77 TRIM24 (0.33) TRIM24TRIM33ALDH1A1
SCHEMBL8008584 0.77 ALDH1A1 (0.38) TRIM24TRIM33LMNAALDH1A1TSHR
SCHEMBL3543067 0.76 KDM4E (0.45) TRIM24TRIM33KDM4ELMNACYP2C19
SCHEMBL16179651 0.76 KDM4E (0.45) TRIM24TRIM33KDM4ELMNACYP2C19
SCHEMBL12648094 0.76 KDM4E (0.45) TRIM24TRIM33KDM4ELMNACYP2C19
SCHEMBL14235092 0.75
SCHEMBL6402600 0.74 TRIM24 (0.31) TRIM24TRIM33

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1406891-B1 THIOCHROMENONES USED TO COMBAT PAINFUL CONDITIONS AND NEURODEGENERATIVE DISEASES BAYER HEALTHCARE AG (DE) 2006-03-22 EP disclosed
US-20050009820-A1 Thiochromenones used to combat painful conditions and neurodegenerative diseases BAYER HEALTHCARE AG (DE) 2005-01-13 US disclosed
EP-1406891-A1 THIOCHROMENONES USED TO COMBAT PAINFUL CONDITIONS AND NEURODEGENERATIVE DISEASES Bayer HealthCare AG (DE) 2004-04-14 EP disclosed
WO-2003053955-A1 THIOCHROMENONES USED TO COMBAT PAINFUL CONDITIONS AND NEURODEGENERATIVE DISEASES BAYER HEALTHCARE AG (DE) 2003-07-03 WO 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-20050009820-A1 Thiochromenones used to combat painful conditions and neurodegenerative diseases HTT, HMOX1, SNCA TRIM24 1791/4885TRIM33 2091/4885KDM4E 2960/4885

“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.