SCHEMBL7875447

SCHEMBL7875447

OCC(O)COc1c(I)cc(I)cc1I

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.41
MAPK1 P28482 1/20 0.41
CYP1A2 P05177 3/20 0.40
KDM4E B2RXH2 2/20 0.40
AGTR1 P30556 1/20 0.40
LMNA P02545 1/20 0.40
MEN1 O00255 1/20 0.38
CYP2C19 P33261 1/20 0.38
KMT2A Q03164 1/20 0.38
AR P10275 5/20 0.34
TTR P02766 1/20 0.33
VDR P11473 7/20 0.33
PCNA P12004 1/20 0.33
LIG1 P18858 1/20 0.33
FGFR1 P11362 1/20 0.32
GLA P06280 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL34468007 0.83 TSHR (0.47) TSHRKMT2ATTRGLAMAPT
SCHEMBL24632341 0.82 TTR (0.37) TTR
SCHEMBL34467969 0.81 PCNA (0.42) TTRPCNALIG1
SCHEMBL28192713 0.75 TTR (0.39) LMNATTR
SCHEMBL10636603 0.73 TSHR (0.40) TSHRCYP1A2KDM4ELMNAMEN1
SCHEMBL15162110 0.73 TTR (0.40) MEN1KMT2ATTR
SCHEMBL31615954 0.72 SCN4A (0.50) TSHRCYP1A2LMNA
SCHEMBL8656427 0.72 TSHR (0.42) TSHRCYP1A2KDM4ELMNAMEN1
SCHEMBL7784286 0.72
SCHEMBL7784290 0.71 MEN1 (0.33) CYP1A2KDM4ELMNAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6168655-B1 PHENOL DERIVATIVES KIMBERLY-CLARK WORLDWIDE, INC. 2001-01-02 US disclosed
US-6099628-A A PORPHINE STABILIZER IMPARTS LIGHT-STABILITY TO THE COLORANT WHEN EXPOSED TO ELECTROMAGNETIC RADIATION SUCH AS SUNLIGHT OR ARTIFICIAL LIGHT KIMBERLY-CLARK WORLDWIDE, INC. (US) 2000-08-08 US disclosed
US-5885337-A COMPRISING A REDUCING AGENT AND/OR A MOLECULAR INCLUSION COMPOUND FOR INHIBITING DISCOLORATION WHEN EXPOSED TO SUNLIGHT OR ARTIFICIAL LIGHT NOHR RONALD SINCLAIR (US) 1999-03-23 US disclosed
US-5855655-A INKS OF THE INK SET POSSESS SUBSTANTIALLY SIMILAR LIGHT FASTNESS PROPERTIES, ONE INK IS MAGENTA KIMBERLY-CLARK WORLDWIDE, INC. (US) 1999-01-05 US disclosed
EP-0854896-A2 IMPROVED COLORANT STABILIZERS Kimberly-Clark Worldwide, Inc. (US) 1998-07-29 EP disclosed
US-5782963-A PHOTOSTABILITY, PORPHINES, ARYLIMINEALKENE KIMBERLY-CLARK WORLDWIDE, INC. (US) 1998-07-21 US disclosed
WO-1997020000-A2 IMPROVED COLORANT STABILIZERS KIMBERLY-CLARK WORLDWIDE, INC. (US) 1997-06-05 WO disclosed