SCHEMBL6502371

SCHEMBL6502371

Cc1cc(-c2ccc3c(=O)c4c(sc3c2)CC(C)(C)CC4)cnc1C

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 1/20 0.38
WDR77 Q9BQA1 1/20 0.38
LIMK1 P53667 1/20 0.34
CYP2A6 P11509 1/20 0.32
SLC34A2 O95436 1/20 0.31
PRKCI P41743 1/20 0.31
PIK3CA P42336 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
SCHEMBL5741883 0.85 PIK3CG (0.38) PRMT5WDR77LIMK1CYP2A6PRKCI
SCHEMBL5741287 0.84 LIMK1 (0.36) LIMK1SLC34A2PRKCI
SCHEMBL5738867 0.82 ABL1 (0.40) PRMT5WDR77
SCHEMBL5741185 0.82 PIK3CG (0.42) LIMK1CYP2A6PIK3CA
SCHEMBL5738937 0.81 LIMK1 (0.40) LIMK1PIK3CA
SCHEMBL5740852 0.80 CYP11B2 (0.40) LIMK1PRKCI
SCHEMBL5739106 0.77 CYP11B2 (0.43) PRMT5WDR77CYP2A6PIK3CA
SCHEMBL5738790 0.77 LIMK1 (0.38) LIMK1SLC34A2
SCHEMBL5738998 0.77 LIMK1 (0.34) LIMK1
SCHEMBL5740480 0.76 KIF11 (0.37)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 PRMT5 3297/4885WDR77 2046/4885LIMK1 4255/4885

“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.