SCHEMBL8378010

SCHEMBL8378010

Cc1cc(Oc2ccccc2C)ccc1O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.44
MEN1 O00255 2/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
KMT2A Q03164 2/20 0.44
TSHR P16473 1/20 0.44
HTR2A P28223 1/20 0.44
SLC6A4 P31645 1/20 0.44
ALDH1A1 P00352 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 1/20 0.44
HPGD P15428 1/20 0.44
CYP2C19 P33261 1/20 0.44
PTGS2 P35354 1/20 0.43
LPAR1 Q92633 1/20 0.43
LPAR5 Q9H1C0 1/20 0.43
FFAR1 O14842 1/20 0.42
TP53 P04637 1/20 0.42
TDP1 Q9NUW8 1/20 0.42

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
SCHEMBL17716501 0.89 AR (0.47) ARMEN1NPC1RAB9AKMT2A
SCHEMBL923048 0.86 TRPA1 (0.44) ARMEN1NPC1RAB9AKMT2A
SCHEMBL12259261 0.82 HTR2A (0.60) ARSMN1; SMN2MEN1NPC1RAB9A
SCHEMBL135848 0.82 TP53 (0.54) ARMEN1NPC1RAB9AKMT2A
SCHEMBL30058647 0.82 TP53 (0.54) ARMEN1NPC1RAB9AKMT2A
SCHEMBL9853718 0.82 NCOA1 (0.53) ARHTR2ASLC6A4ALDH1A1HPGD
SCHEMBL20308924 0.82 SIRT2 (0.44) SMN1; SMN2MEN1NPC1RAB9AKMT2A
SCHEMBL4101422 0.81 LTA4H (0.54) MEN1NPC1RAB9AKMT2ATSHR
SCHEMBL11169319 0.80 ALDH1A1 (0.42) ARALDH1A1TP53TDP1ESR1
SCHEMBL7690257 0.80 ALDH1A1 (0.59) ARSMN1; SMN2MEN1NPC1RAB9A

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
CN-101842246-B Thermal recording medium JUJO PAPER CO LTD 2012-07-04 CN disclosed
CN-101842246-A Thermal recording medium JUJO PAPER CO LTD 2010-09-22 CN disclosed
EP-0659801-B1 Polyimide MITSUI CHEMICALS INC (JP) 1999-03-10 EP disclosed
US-5484880-A HEAT RESISTANT POLYMERS FOR APPLIANCES AND INJECTION MOLDED ARTICLES OR FILMS MITSUI TOATSU CHEMICALS, INC. (JP) 1996-01-16 US disclosed
EP-0659801-A1 Polyimide MITSUI TOATSU CHEMICALS, Inc. (JP) 1995-06-28 EP disclosed