SCHEMBL11223911

SCHEMBL11223911

CCN(CC)[C](C)CC(C)O

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.38
TDP1 Q9NUW8 1/20 0.32
ABCB11 O95342 1/20 0.31
CYP2E1 P05181 1/20 0.31
PTGS1 P23219 1/20 0.31
HTT P42858 1/20 0.31
GSDMD P57764 1/20 0.31
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA4 P22748 1/20 0.31
CA9 Q16790 1/20 0.31
EHMT2 Q96KQ7 1/20 0.31
EHMT1 Q9H9B1 1/20 0.31
ALDH1A1 P00352 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
SCHEMBL3910063 0.72 LMNA (0.48) TSHRABCB11HTTGSDMDEHMT2
SCHEMBL3910061 0.72 LMNA (0.48) TSHRABCB11HTTGSDMDEHMT2
SCHEMBL3913645 0.72 LMNA (0.48) TSHRABCB11HTTGSDMDEHMT2
SCHEMBL8440401 0.67
SCHEMBL8474938 0.67 EHMT2 (0.33) TSHRTDP1ABCB11CYP2E1PTGS1
SCHEMBL122748 0.65
SCHEMBL7528871 0.65
SCHEMBL7526128 0.65
SCHEMBL10391701 0.65 LMNA (0.36) TSHRCA12CA1CA2CA9
SCHEMBL8057917 0.64 TSHR (0.44) TSHRTDP1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0012804-B1 Salts of a non toxic, activated anion exchange resin capable of establishing a stable binding with bile acids and 2-(4'-(p-chlorobenzoyl)-phenoxy)-2-(methyl)-propionic acid and pharmaceutical compositions comprising these salts ALFA FARMACEUTICI S.p.A. (IT) 1981-12-30 EP claimed
US-4340585-A Salified anionic resin for cholesterol and lipid lowering ALFA FARMACEUTICI, S.P.A. (IT) 1982-07-20 US disclosed