SCHEMBL6072587

SCHEMBL6072587

OCc1c(F)ccc(Cl)c1Cl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.41
GAA P10253 1/20 0.38
CYP3A4 P08684 3/20 0.36
MAPK1 P28482 2/20 0.36
NOTUM Q6P988 1/20 0.35
P2RX7 Q99572 2/20 0.35
BACE1 P56817 1/20 0.33
CNR1 P21554 1/20 0.33
NR4A2 P43354 1/20 0.33
CD38 P28907 1/20 0.33
KDM4E B2RXH2 1/20 0.33
CYP2A13 Q16696 1/20 0.33
SLC2A1 P11166 1/20 0.32
MAPT P10636 2/20 0.31
KMT2A Q03164 2/20 0.31
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
USP2 O75604 1/20 0.31
EGFR P00533 1/20 0.31
LMNA P02545 1/20 0.31

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
SCHEMBL488488 0.86 TAAR1 (0.39) TAAR1GAANOTUMP2RX7BACE1
SCHEMBL1358925 0.82 NOTUM (0.42) TAAR1GAACYP3A4MAPK1NOTUM
SCHEMBL616685 0.82 TAAR1 (0.41) TAAR1GAANOTUMBACE1CNR1
SCHEMBL11677898 0.80 NOTUM (0.47) TAAR1CYP3A4MAPK1NOTUMMAPT
SCHEMBL1167603 0.78 P2RX7 (0.43) TAAR1GAACYP3A4P2RX7NR4A2
SCHEMBL29705432 0.78 TAAR1 (0.38) TAAR1GAACYP3A4MAPK1BACE1
SCHEMBL18585398 0.78 TAAR1 (0.34) TAAR1GAANR4A2KDM4ECYP1A2
SCHEMBL27215165 0.78 TAAR1 (0.38) TAAR1GAACYP3A4MAPK1BACE1
SCHEMBL4120436 0.77 TAAR1 (0.36) TAAR1GAACYP3A4MAPK1P2RX7
SCHEMBL6072548 0.77 TAAR1 (0.36) TAAR1GAACYP3A4MAPK1P2RX7

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
WO-2006062477-A1 CHEMICAL PROCESS ASTRAZENECA AB (SE) 2006-06-15 WO disclosed