SCHEMBL2303908

SCHEMBL2303908

COc1ccc(C=O)c(CO)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRIM24 O15164 1/20 0.61
TYR P14679 1/20 0.61
TRIM33 Q9UPN9 1/20 0.61
ALDH1A1 P00352 9/20 0.58
ERN1 O75460 3/20 0.56
KDM4E B2RXH2 3/20 0.46
CYP1A2 P05177 3/20 0.45
MAPT P10636 2/20 0.45
CYP2C19 P33261 2/20 0.45
HSD17B10 Q99714 1/20 0.44
CYP1A1 P04798 1/20 0.43
CYP1B1 Q16678 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
CYP2A6 P11509 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
LMNA P02545 1/20 0.41
CYP2C9 P11712 1/20 0.41
BAZ2B Q9UIF8 1/20 0.41
BAZ2A Q9UIF9 1/20 0.41

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
SCHEMBL29414471 0.85 ALDH1A1 (0.61) TRIM24TYRTRIM33ALDH1A1ERN1
SCHEMBL15935610 0.85 ALDH1A1 (0.61) TRIM24TYRTRIM33ALDH1A1ERN1
SCHEMBL8381545 0.82 ALDH1A1 (0.58) TRIM24TYRTRIM33ALDH1A1ERN1
SCHEMBL11766619 0.82 ALDH1A1 (0.58) TRIM24TYRTRIM33ALDH1A1ERN1
SCHEMBL31561376 0.81 HSD17B10 (0.64) TRIM24TYRTRIM33ALDH1A1ERN1
SCHEMBL9090045 0.81 HSD17B10 (0.64) TRIM24TYRTRIM33ALDH1A1ERN1
SCHEMBL1347929 0.81 ALDH1A1 (0.56) TRIM24TYRTRIM33ALDH1A1ERN1
SCHEMBL26046444 0.81 CYP1A1 (0.46) TRIM24TYRTRIM33ALDH1A1KDM4E
SCHEMBL27756692 0.81 CYP1A1 (0.46) TRIM24TYRTRIM33ALDH1A1KDM4E
SCHEMBL18400737 0.79 TAAR1 (0.60) TRIM24TYRTRIM33ALDH1A1ERN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015140023-A2 METHOD FOR PRODUCING TERTIARY AMINES BASF SE (DE) 2015-09-24 WO disclosed
EP-2536768-B1 METHOD FOR PRODUCING HIGHLY REACTIVE ISOBUTENE HOMO OR COPOLYMERS BASF SE (DE) 2015-04-08 EP disclosed
EP-2742073-A1 PROCESS FOR PREPARING HIGH-REACTIVITY ISOBUTENE HOMO- OR COPOLYMERS BASF SE (DE) 2014-06-18 EP disclosed
EP-2646478-A2 PRODUCTION OF ISOBUTYLENE HOMOPOLYMER OR COPOLYMER DERIVATIVES BASF SE (DE) 2013-10-09 EP disclosed
WO-2013021058-A1 PROCESS FOR PREPARING HIGH-REACTIVITY ISOBUTENE HOMO- OR COPOLYMERS BASF SE (DE) 2013-02-14 WO disclosed
EP-2536768-A1 METHOD FOR PRODUCING HIGHLY REACTIVE ISOBUTENE HOMO OR COPOLYMERS BASF SE (DE) 2012-12-26 EP disclosed
WO-2012072536-A2 PRODUCTION OF ISOBUTYLENE COPOLYMER DERIVATIVES BASF SE (DE) 2012-06-07 WO disclosed
WO-2012072643-A2 PRODUCTION OF ISOBUTYLENE HOMOPOLYMER OR COPOLYMER DERIVATIVES BASF SE (DE) 2012-06-07 WO disclosed
WO-2011101281-A1 METHOD FOR PRODUCING HIGHLY REACTIVE ISOBUTENE HOMO OR COPOLYMERS BASF SE (DE) 2011-08-25 WO disclosed