SCHEMBL19953285

SCHEMBL19953285

NCc1cc2cc(-c3ccc(Oc4ccccc4)nc3)ccc2[nH]1

nearest known ligand 0.73

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 11/20 0.73
GPR84 Q9NQS5 1/20 0.45
LTA4H P09960 1/20 0.44
RHEB Q15382 1/20 0.42
GRM2 Q14416 1/20 0.41
ACACB O00763 1/20 0.40
ACACA Q13085 1/20 0.40
F2 P00734 1/20 0.39
LOX P28300 1/20 0.39
CHEK2 O96017 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
SCHEMBL19964313 0.85 LOXL2 (1.00) LOXL2CHEK2
Hydrochloric Acid SCHEMBL19953384 0.84 LOXL2 (0.98) LOXL2
SCHEMBL19964757 0.83 LOXL2 (1.00) LOXL2
SCHEMBL19953219 0.76 LOXL2 (0.60) LOXL2
SCHEMBL19953274 0.73 LOXL2 (0.65) LOXL2
SCHEMBL400512 0.68 LOXL2 (0.62) LOXL2
SCHEMBL19953414 0.68 LOXL2 (0.57) LOXL2
SCHEMBL6160873 0.67 LOXL2 (0.58) LOXL2LTA4HACACBLOX
SCHEMBL19964478 0.67 LOXL2 (1.00) LOXL2
SCHEMBL19953383 0.67 LOXL2 (0.56) LOXL2

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
WO-2018048930-A1 LYSYL OXIDASE-LIKE 2 INHIBITORS AND USES THEREOF PHARMAKEA, INC. (US) 2018-03-15 WO claimed
WO-2018048930-A1 LYSYL OXIDASE-LIKE 2 INHIBITORS AND USES THEREOF PHARMAKEA, INC. (US) 2018-03-15 WO disclosed
WO-2018048930-A1 LYSYL OXIDASE-LIKE 2 INHIBITORS AND USES THEREOF PHARMAKEA, INC. (US) 2018-03-15 WO disclosed