SCHEMBL7067742

SCHEMBL7067742

CCOCC(Cl)(COCC)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.41
TSHR P16473 1/20 0.41
KCNN4 O15554 3/20 0.38
ALOX15 P16050 2/20 0.34
CYP1A2 P05177 1/20 0.34
TAAR1 Q96RJ0 1/20 0.34
ALDH1A1 P00352 1/20 0.34
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
ACSS2 Q9NR19 1/20 0.33
TACR1 P25103 1/20 0.33
KIF11 P52732 1/20 0.33
LTA4H P09960 1/20 0.32

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
SCHEMBL10596863 0.83 HSP90AA1 (0.44) MAPK1MEN1KMT2ALTA4H
SCHEMBL14269138 0.78 MAPK1 (0.44) MAPK1KCNN4ALOX15TAAR1ALDH1A1
SCHEMBL7066960 0.78 TSHR (0.44) MAPK1TSHRKCNN4ALOX15CYP1A2
SCHEMBL7069369 0.78 TSHR (0.39) MAPK1TSHRKCNN4CYP1A2ALDH1A1
SCHEMBL11497301 0.77 MAPK1 (0.48) MAPK1KCNN4ALOX15TAAR1ALDH1A1
SCHEMBL8911590 0.75 CYP1A2 (0.47) MAPK1TSHRKCNN4ALOX15CYP1A2
SCHEMBL662471 0.75 SMN1; SMN2 (0.44) MAPK1ALOX15CYP1A2ALDH1A1MEN1
SCHEMBL11065318 0.75 MAPK1 (0.41) MAPK1KCNN4ALOX15CYP1A2TAAR1
SCHEMBL28366627 0.75 TSHR (0.50) MAPK1TSHRKCNN4ALOX15CYP1A2
SCHEMBL7069034 0.74 ALOX15 (0.35) MAPK1TSHRKCNN4ALOX15KIF11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0891988-B1 Components and catalysts for the polymerization of olefins BASELL POLIOLEFINE SPA (IT) 2003-06-04 EP disclosed
EP-0451645-B1 Components and catalysts for the polymerization of olefins MONTELL NORTH AMERICA INC (US) 1999-05-12 EP disclosed
EP-0891988-A2 Components and catalysts for the polymerization of olefins MONTELL NORTH AMERICA INC. (US) 1999-01-20 EP disclosed
US-5068213-A COMPONENTS AND CATALYSTS FOR THE POLYMERIZATION OF OLEFINS HINMONT INCORPORATED (US) 1991-11-26 US disclosed
EP-0451645-A2 Components and catalysts for the polymerization of olefins MONTELL NORTH AMERICA INC. (US) 1991-10-16 EP disclosed