SCHEMBL5740798

SCHEMBL5740798

CC1(C)CCc2c(sc3cc(CCl)ccc3c2=O)C1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LIMK1 P53667 1/20 0.33
SLC34A2 O95436 2/20 0.32
KIF11 P52732 1/20 0.31
S1PR1 P21453 1/20 0.31
CACNA1G O43497 1/20 0.31
CACNA1H O95180 1/20 0.31
CACNA1I Q9P0X4 1/20 0.31
PRKCI P41743 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
SCHEMBL5740408 0.88 SLC34A2 (0.35) LIMK1SLC34A2KIF11S1PR1CACNA1G
SCHEMBL5740285 0.85 CYP26A1 (0.40) SLC34A2KIF11S1PR1CACNA1GCACNA1H
SCHEMBL5739244 0.85 L3MBTL1 (0.33) LIMK1SLC34A2KIF11
SCHEMBL5740233 0.81 LIMK1 (0.40) LIMK1KIF11PRKCI
SCHEMBL5738947 0.81 LIMK1 (0.35) LIMK1KIF11CACNA1GCACNA1HCACNA1I
SCHEMBL5741839 0.78 RXRA (0.37) LIMK1SLC34A2KIF11
SCHEMBL5741193 0.78 POLB (0.35) LIMK1
SCHEMBL6508440 0.78 KIF11 (0.34) SLC34A2KIF11S1PR1
SCHEMBL5739197 0.76 LIMK1 (0.34) LIMK1KIF11
SCHEMBL5741287 0.75 LIMK1 (0.36) LIMK1SLC34A2PRKCI

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 LIMK1 4255/4885SLC34A2 2985/4885KIF11 2553/4885

“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.