SCHEMBL5215818

SCHEMBL5215818

C[SiH](C)c1c(I)cccc1OC(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.35
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL2760211 0.76 KCNH2 (0.37) KCNH2KDM4EALDH1A1HSD17B10
SCHEMBL21145423 0.74 ALDH1A1 (0.33) KCNH2ALDH1A1
SCHEMBL26586427 0.73 KCNH2 (0.37) KCNH2
SCHEMBL3295512 0.72 KCNH2 (0.42) KCNH2KDM4EALDH1A1HSD17B10
SCHEMBL3817668 0.71 ALDH1A1 (0.46) KCNH2KDM4EALDH1A1HSD17B10
SCHEMBL26586530 0.69 KCNH2 (0.34) KCNH2
SCHEMBL29428931 0.67 CA1 (0.45) KCNH2KDM4EALDH1A1HSD17B10
SCHEMBL3820431 0.67 CA1 (0.45) KCNH2KDM4EALDH1A1HSD17B10
SCHEMBL26586642 0.67 KCNH2 (0.33) KCNH2
SCHEMBL11553756 0.66 KCNH2 (0.43) KCNH2KDM4EALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1181014-B1 HETEROCYCLIC CONTAINING BIPHENYL aP2 INHIBITORS AND METHOD BRISTOL MYERS SQUIBB CO (US) 2007-05-23 EP disclosed
EP-1754705-A2 Antagonists for treatment of CD11/CD18 adhesion receptor mediated disorders Genentech, Inc. (US) 2007-02-21 EP disclosed
EP-1063982-B1 ANTAGONISTS FOR TREATMENT OF CD11/CD18 ADHESION RECEPTOR MEDIATED DISORDERS GENENTECH INC (US) 2007-02-14 EP disclosed
US-20050203135-A1 Antagonists for treatment of CD/11CD18 adhesion receptor mediated disorders GENENTECH, INC. 2005-09-15 US disclosed
US-6927227-B2 Heterocyclic containing biphenyl aP2 inhibitors and method BRISTOL-MYERS SQUIBB COMPANY (US) 2005-08-09 US disclosed
US-20030199563-A1 Heterocyclic containing biphenyl aP2 inhibitors and method ROBL JEFFREY A (US) 2003-10-23 US disclosed
US-6548529-B1 AP2 (adipocyte fatty binding protein); biphenyl-substituted pyrazoles of given formula; treating diabetes and related diseases; mixtures with other antidiabetic agents such as metformin, glyburide, troglitazone and/or insulin BRISTOL-MYERS SQUIBB COMPANY 2003-04-15 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 (2 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-20050203135-A1 Antagonists for treatment of CD/11CD18 adhesion receptor mediated disorders VCAM1, CD58, ITGB8 KCNH2 2520/4885KDM4E 3946/4885ALDH1A1 280/4885
US-20030199563-A1 Heterocyclic containing biphenyl aP2 inhibitors and method AP2B1, AP2A2, AP2A1 KCNH2 2263/4885KDM4E 3079/4885ALDH1A1 2810/4885

“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.