SCHEMBL4390620

SCHEMBL4390620

O=c1oc2ccccc2cc1CCBr

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 1/20 0.60
MMP9 P14780 1/20 0.60
ADAM17 P78536 1/20 0.60
MAOA P21397 2/20 0.55
MAOB P27338 6/20 0.54
TYR P14679 1/20 0.51
DAO P14920 1/20 0.51
AKR1B1 P15121 1/20 0.51
HPGD P15428 1/20 0.51
POLB P06746 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
RAB9A P51151 3/20 0.50
KMT2A Q03164 3/20 0.50
NPC1 O15118 2/20 0.50
MEN1 O00255 2/20 0.50
KDM4E B2RXH2 2/20 0.49
ALDH1A1 P00352 1/20 0.49
LMNA P02545 2/20 0.48
CA12 O43570 3/20 0.47
CA9 Q16790 3/20 0.47

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
Methylamine SCHEMBL28468200 0.95 MMP2 (0.56) MMP2MMP9ADAM17MAOAMAOB
SCHEMBL27625488 0.89 MMP2 (0.67) MMP2MMP9ADAM17MAOAMAOB
SCHEMBL765821 0.86 MAOA (0.58) MMP2MMP9ADAM17MAOAMAOB
SCHEMBL11092927 0.83 MAOB (0.66) MMP2MMP9ADAM17MAOAMAOB
SCHEMBL4927452 0.83 MMP2 (0.64) MMP2MMP9ADAM17MAOAMAOB
SCHEMBL31320649 0.83 MMP2 (0.64) MMP2MMP9ADAM17MAOAMAOB
SCHEMBL293739 0.83 MMP2 (0.60) MMP2MMP9ADAM17MAOAMAOB
SCHEMBL30311162 0.83 MMP2 (0.60) MMP2MMP9ADAM17MAOAMAOB
SCHEMBL13612673 0.82 MAOA (0.61) MMP2MMP9ADAM17MAOAMAOB
SCHEMBL1619109 0.80 MAOB (0.67) MMP2MMP9ADAM17MAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8754179-B2 Light activated shape memory co-polymers CORNERSTONE RESEARCH GROUP, INC. (US) 2014-06-17 US disclosed
US-7629400-B2 Image making medium HYMAN SYDNEY 2009-12-08 US disclosed
US-20080021166-A1 Light Activated Shape Memory Co-Polymers GOVERNMENT OF THE UNITED STATES AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE 2008-01-24 US disclosed
US-20030035917-A1 Image making medium HYMAN SYDNEY (US) 2003-02-20 US disclosed
US-5151424-A Antiallergens or antihistamines JANSSEN PHARMACEUTICA N.V. (BE) 1992-09-29 US disclosed
EP-0297661-B1 [(Bicyclic heterocyclyl)methyl and -hetero] substituted hexahydro-1H-azepines and pyrrolidines JANSSEN PHARMACEUTICA N.V. (BE) 1992-09-16 EP disclosed
US-5071846-A Anti-hystaminic [(bicyclic heterocyclyl) methyl and --hetero] substituted hexahydro-1H-azepines and pyrrolidines JANSSEN PHARMACEUTICA N.V. (BE) 1991-12-10 US disclosed
US-4988689-A Antiallergens, antihistamines JANSSEN PHARMACEUTICA N.V. (BE) 1991-01-29 US disclosed
EP-0151824-B1 N-(4-PIPERIDINYL) BICYCLIC CONDENSED 2-IMIDAZOLAMINE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 1990-04-04 EP disclosed
EP-0297661-A1 [(Bicyclic heterocyclyl)methyl and -hetero] substituted hexahydro-1H-azepines and pyrrolidines JANSSEN PHARMACEUTICA N.V. (BE) 1989-01-04 EP disclosed
EP-0151824-A2 N-(4-piperidinyl) bicyclic condensed 2-imidazolamine derivatives JANSSEN PHARMACEUTICA N.V. (BE) 1985-08-21 EP disclosed