SCHEMBL6633153

SCHEMBL6633153

Cc1ccc(C2=C(c3ccccc3)C(C)c3ccccc32)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
POLB P06746 2/20 0.38
EDNRB P24530 1/20 0.36
EDNRA P25101 1/20 0.36
NPC1 O15118 3/20 0.36
RAB9A P51151 3/20 0.36
TDP1 Q9NUW8 3/20 0.36
HPGD P15428 2/20 0.36
NFKB1 P19838 2/20 0.36
NFKB2 Q00653 2/20 0.36
RELA Q04206 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
AGTR1 P30556 1/20 0.34
ALDH1A1 P00352 2/20 0.34
MAPT P10636 2/20 0.34
LMNA P02545 3/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
FLT3 P36888 1/20 0.33
MAPK1 P28482 1/20 0.33

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
SCHEMBL27916062 0.91 ALDH1A1 (0.35) HPGDALDH1A1MAPTLMNA
SCHEMBL6632251 0.83 MAPT (0.43) MEN1KMT2AEDNRBEDNRANPC1
Hydrochloric Acid SCHEMBL6927081 0.75
Hydrochloric Acid SCHEMBL6923403 0.75
SCHEMBL7926988 0.75 DRD2 (0.31)
SCHEMBL28814695 0.72 GPR3 (0.36) MEN1KMT2APOLBLMNA
SCHEMBL6569636 0.71 ALDH1A1 (0.40) KMT2ANPC1RAB9ATDP1ALDH1A1
SCHEMBL7028244 0.70 CHRNB2 (0.33) MEN1KMT2ASMN1; SMN2
SCHEMBL16321982 0.70 CHRNB2 (0.33)
SCHEMBL7026733 0.70 CHRNB2 (0.33) MEN1KMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1033130-B1 INHIBITOR OF UROKINASE PRODUCTION AND OF ANGIOGENESIS AND ITS THERAPEUTIC USE TAIHO PHARMACEUTICAL CO LTD (JP) 2004-04-21 EP disclosed
US-6365610-B1 1,4-EPOXY-2,3-BENZODIOXEPINS OR 1,4-EPOXY-3,2-BENZOXAZEPINES TAIHO PHARMACEUTICAL COMPANY LTD. (JP) 2002-04-02 US disclosed
EP-1033130-A1 UROKINASE PRODUCTION INHIBITORS, ANGIOGENESIS INHIBITORS AND METHODS OF PREVENTION OR TREATMENT WITH BOTH TAIHO PHARMACEUTICAL COMPANY LIMITED (JP) 2000-09-06 EP disclosed