SCHEMBL20008385

SCHEMBL20008385

C=C1C(N2CCOCC2)=CC(c2cc(NC)ccc2C)=CN1C

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.35
RAF1 P04049 11/20 0.35
BRAF P15056 10/20 0.35
ALDH1A1 P00352 2/20 0.34
GAA P10253 2/20 0.34
NPSR1 Q6W5P4 2/20 0.34
MAPK1 P28482 2/20 0.34
LMNA P02545 1/20 0.34
PTK2B Q14289 1/20 0.34
TDP1 Q9NUW8 1/20 0.33
KDM4E B2RXH2 1/20 0.33
HPGD P15428 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
POLB P06746 1/20 0.32
AR P10275 1/20 0.32
TP53 P04637 1/20 0.32

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
SCHEMBL24885810 0.65 RAF1 (0.70) RAF1BRAF
SCHEMBL20008152 0.61 RAF1 (0.63) RAF1BRAF
SCHEMBL24319054 0.61 RAF1 (0.63) RAF1BRAF
SCHEMBL487498 0.61 GAA (0.56) MAPTALDH1A1GAANPSR1MAPK1
SCHEMBL24318973 0.60 RAF1 (0.67) RAF1BRAF
Hydrochloric Acid SCHEMBL28349769 0.60 GAA (0.54) MAPTALDH1A1GAANPSR1MAPK1
SCHEMBL21999244 0.59 HTT (0.55) MAPTALDH1A1MAPK1LMNAHPGD
SCHEMBL17359402 0.59 MAPT (0.43) MAPTALDH1A1GAAMAPK1LMNA
SCHEMBL108137 0.58 LMNA (0.53) MAPTALDH1A1MAPK1LMNAPOLB
SCHEMBL14621614 0.58 POLB (0.56) MAPTALDH1A1TDP1KDM4ESMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3299367-A1 BIARYL AMIDE COMPOUNDS AS KINASE INHIBITORS Novartis AG (CH) 2018-03-28 EP disclosed