SCHEMBL633828

SCHEMBL633828

C=C(CC)c1ccccc1.CC=Cc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 6/20 0.39
MAOA P21397 5/20 0.39
LMNA P02545 2/20 0.39
MAPT P10636 2/20 0.39
PLIN1 O60240 1/20 0.39
BCHE P06276 1/20 0.39
TNFRSF1A P19438 1/20 0.39
ACHE P22303 1/20 0.39
RECQL P46063 1/20 0.39
PLIN5 Q00G26 1/20 0.39
CYP1B1 Q16678 1/20 0.39
ABHD5 Q8WTS1 1/20 0.39
ESR1 P03372 1/20 0.39
PGR P06401 1/20 0.39
ESR2 Q92731 1/20 0.39
TDP1 Q9NUW8 2/20 0.38
NPC1 O15118 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38

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
SCHEMBL14958 0.82 MAOA (0.52) MAOBMAOAMAPTESR1ESR2
Styrene SCHEMBL3717971 0.81 ALDH1A1 (0.54) MAOBMAOATDP1ALDH1A1ATM
SCHEMBL6578306 0.81 CYP2C19 (0.42) MAOBMAOALMNAMAPTPLIN1
SCHEMBL4660392 0.81 MEN1 (0.41) MAOBMAOALMNAMAPTPLIN1
SCHEMBL11860211 0.81 MEN1 (0.47) MAOBLMNAMAPTPLIN1BCHE
SCHEMBL4968221 0.79 GLA (0.44) MAOBLMNAMAPTPLIN1BCHE
SCHEMBL21748438 0.79 GLA (0.44) MAOBLMNAMAPTPLIN1BCHE
SCHEMBL3262174 0.79 MTNR1A (0.41) MAOBMAOALMNAMAPTRECQL
SCHEMBL9009925 0.79 KDM1A (0.39) MAOBMAOALMNAMAPTL3MBTL1
SCHEMBL1852838 0.78 GLA (0.50) MAOBLMNAMAPTPLIN1RECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2181126-B1 METHOD FOR PROCESSING EFFLUENT FROM CHLOROMETHYLATION OF VINYL AROMATIC POLYMERS DOW GLOBAL TECHNOLOGIES LLC (US) 2012-02-22 EP disclosed
EP-0672738-B1 Adhesive composition ROHM & HAAS (US) 1998-08-12 EP disclosed
US-5480720-A AQUEOUSD DISPERSION OF ADDITION COPOLYMERS OF SPECIFIED GLASS TRANSITION RANGE, POLYFUNCTIONAL EPOXY RESINS/CURATIVES, METAL SALT; POLYOLEFIN FILM LAMINATES; BOND STRENGTH, MOISTURE RESISTANCE ROHM AND HAAS COMPANY (US) 1996-01-02 US disclosed
EP-0672738-A2 Adhesive composition ROHM AND HAAS COMPANY (US) 1995-09-20 EP disclosed