SCHEMBL144972

SCHEMBL144972

COC[C@H](C)Nc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 4/20 0.52
ALDH1A1 P00352 8/20 0.52
CYP3A4 P08684 3/20 0.52
ALOX15 P16050 3/20 0.52
TSHR P16473 3/20 0.52
HSD17B10 Q99714 3/20 0.52
ALOX12 P18054 2/20 0.52
HIF1A Q16665 2/20 0.52
MAPK1 P28482 1/20 0.52
MAPT P10636 1/20 0.50
THRB P10828 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
LMNA P02545 1/20 0.45
RECQL P46063 1/20 0.45
ATM Q13315 1/20 0.45
TP53 P04637 1/20 0.45
HSP90AA1 P07900 1/20 0.45
CASP1 P29466 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
KDM4E B2RXH2 2/20 0.44

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
SCHEMBL9343619 0.93 ALDH1A1 (0.64) TDP1ALDH1A1CYP3A4ALOX15TSHR
SCHEMBL4951647 0.80 ALDH1A1 (0.47) TDP1ALDH1A1CYP3A4ALOX15TSHR
Hydrochloric Acid SCHEMBL4953931 0.79 ALDH1A1 (0.45) TDP1ALDH1A1CYP3A4ALOX15TSHR
SCHEMBL14419741 0.79 SLC6A4 (0.51) TDP1ALDH1A1CYP3A4ALOX15TSHR
SCHEMBL6504114 0.78 MAPT (0.58) TDP1ALDH1A1CYP3A4ALOX15TSHR
SCHEMBL632881 0.76 MAPT (0.47) TDP1ALDH1A1CYP3A4ALOX15TSHR
SCHEMBL8744834 0.76 TDP1 (0.58) TDP1ALDH1A1CYP3A4ALOX15TSHR
SCHEMBL172358 0.76 ALDH1A1 (0.77) TDP1ALDH1A1CYP3A4ALOX15TSHR
SCHEMBL13776661 0.76 ALDH1A1 (0.77) TDP1ALDH1A1CYP3A4ALOX15TSHR
SCHEMBL94935 0.76 ALDH1A1 (0.77) TDP1ALDH1A1CYP3A4ALOX15TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130143824-A1 COMPOSITIONS AND METHODS FOR ENHANCING APOPTOSIS GENENTECH, INC. (US) 2013-06-06 US claimed
US-20120058953-A1 COMPOSITIONS AND METHODS FOR ENHANCING APOPTOSIS GENENTECH, INC. (US) 2012-03-08 US claimed
US-20110039324-A1 COMPOSITIONS AND METHODS FOR ENHANCING APOPTOSIS GENENTECH, INC. (US) 2011-02-17 US claimed
US-20090148921-A1 Compositions and methods for enhancing apoptosis GENENTECH, INC. (US) 2009-06-11 US claimed
EP-1590666-B1 COMPOSITIONS AND METHODS FOR ENHANCING APOPTOSIS GENENTECH INC (US) 2008-07-09 EP claimed
US-20040171554-A1 Compositions and methods for enhancing apoptosis GENENTECH, INC. 2004-09-02 US claimed
US-20130143824-A1 COMPOSITIONS AND METHODS FOR ENHANCING APOPTOSIS GENENTECH, INC. (US) 2013-06-06 US disclosed
US-20120058953-A1 COMPOSITIONS AND METHODS FOR ENHANCING APOPTOSIS GENENTECH, INC. (US) 2012-03-08 US disclosed
US-20110039324-A1 COMPOSITIONS AND METHODS FOR ENHANCING APOPTOSIS GENENTECH, INC. (US) 2011-02-17 US disclosed
US-20090148921-A1 Compositions and methods for enhancing apoptosis GENENTECH, INC. (US) 2009-06-11 US disclosed
EP-1590666-B1 COMPOSITIONS AND METHODS FOR ENHANCING APOPTOSIS GENENTECH INC (US) 2008-07-09 EP disclosed
EP-1590666-A4 COMPOSITIONS AND METHODS FOR ENHANCING APOPTOSIS GENENTECH INC (US) 2006-07-26 EP disclosed
EP-1590666-A1 COMPOSITIONS AND METHODS FOR ENHANCING APOPTOSIS Genentech, Inc. (US) 2005-11-02 EP disclosed
US-20040171554-A1 Compositions and methods for enhancing apoptosis GENENTECH, INC. 2004-09-02 US disclosed
WO-2004072641-A1 COMPOSITIONS AND METHODS FOR ENHANCING APOPTOSIS GENENTECH, INC. (US) 2004-08-26 WO disclosed