SCHEMBL13685281

SCHEMBL13685281

CC(C)(C)[C](C(C)(C)C)P(=O)(OCc1ccccc1)OCc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.56
CETP P11597 3/20 0.47
MAOB P27338 1/20 0.44
ALDH1A1 P00352 3/20 0.43
FOLH1 Q04609 1/20 0.42
SRC P12931 1/20 0.41
PDPK1 O15530 1/20 0.40
MTOR P42345 1/20 0.40
ALPG P10696 1/20 0.40
PTK2B Q14289 1/20 0.40
KDM4E B2RXH2 1/20 0.40
MAPK1 P28482 1/20 0.40
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
PPARG P37231 1/20 0.39
PPARA Q07869 1/20 0.39

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
SCHEMBL4610294 0.84 TSHR (0.55) TSHRCETPMAOBALDH1A1FOLH1
SCHEMBL7520596 0.79 TSHR (0.67) TSHRCETPALDH1A1FOLH1SRC
SCHEMBL4610334 0.78 TSHR (0.60) TSHRCETPMAOBALDH1A1FOLH1
SCHEMBL12044588 0.76 TSHR (0.57) TSHRCETPMAOBALDH1A1FOLH1
SCHEMBL20701826 0.75 TSHR (0.79) TSHRCETPMAOBALDH1A1FOLH1
SCHEMBL4609918 0.75 TSHR (0.56) TSHRCETPMAOBALDH1A1FOLH1
SCHEMBL11333838 0.75 TSHR (0.56) TSHRCETPMAOBALDH1A1FOLH1
SCHEMBL18526356 0.74 TSHR (0.47) TSHRCETPMAOBALDH1A1FOLH1
SCHEMBL11592226 0.74 TSHR (0.60) TSHRCETPALDH1A1FOLH1MAPK1
SCHEMBL23084624 0.74 TSHR (0.70) TSHRCETPMAOBALDH1A1FOLH1

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
WO-2016166470-A1 METHOD FOR DUAL PHOTOCHEMICAL/THERMAL CROSSLINKING ACTIVATABLE UNDER UV/VISIBLE IRRADIATION, AND COMPOSITION FOR IMPLEMENTING SAID METHOD UNIVERSITÉ DE HAUTE-ALSACE (FR) 2016-10-20 WO claimed
EP-1776399-B1 MONODISPERSE POLYMERS CONTAINING (ALKYL)ACRYLIC ACID MOIETIES, PRECURSORS AND METHODS FOR MAKING THEM AND THEIR APPLICATIONS UNIV GENT (BE) 2012-11-14 EP claimed
WO-2016166470-A1 METHOD FOR DUAL PHOTOCHEMICAL/THERMAL CROSSLINKING ACTIVATABLE UNDER UV/VISIBLE IRRADIATION, AND COMPOSITION FOR IMPLEMENTING SAID METHOD UNIVERSITÉ DE HAUTE-ALSACE (FR) 2016-10-20 WO disclosed