SCHEMBL8720360

SCHEMBL8720360

COc1ccc(-c2cccc(C)c2-c2c(C)cccc2P)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 2/20 0.46
ABCB1 P08183 2/20 0.46
BCR P11274 2/20 0.46
HDAC4 P56524 1/20 0.45
HDAC2 Q92769 1/20 0.45
HDAC8 Q9BY41 1/20 0.45
APP P05067 3/20 0.43
NR1H4 Q96RI1 1/20 0.42
ALDH1A1 P00352 1/20 0.41
SYK P43405 1/20 0.41
MAPT P10636 2/20 0.40
NPC1 O15118 1/20 0.40
TP53 P04637 1/20 0.40
TSHR P16473 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CCNE2 O96020 1/20 0.39
CDK4 P11802 1/20 0.39
CCND1 P24385 1/20 0.39
CCNE1 P24864 1/20 0.39

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
SCHEMBL54542 0.86 ABL1 (0.52) ABL1ABCB1BCRHDAC4HDAC2
SCHEMBL8724561 0.82 ADORA3 (0.38) MAPTNPC1RAB9AENPP1ADORA3
SCHEMBL12843389 0.78 SYK (0.53) ABL1ABCB1BCRAPPALDH1A1
SCHEMBL8720361 0.78 ABL1 (0.47) ABL1ABCB1BCRHDAC4HDAC2
SCHEMBL3794694 0.77 NPC1 (0.51) ABL1ABCB1BCRHDAC4HDAC2
SCHEMBL14604251 0.77 ABL1 (0.58) ABL1ABCB1BCRHDAC4HDAC2
SCHEMBL10304847 0.77 ABL1 (0.53) ABL1ABCB1BCRHDAC4HDAC2
SCHEMBL321832 0.76 ABL1 (0.62) ABL1ABCB1BCRHDAC4HDAC2
SCHEMBL13241127 0.75 ABL1 (0.52) ABL1ABCB1BCRHDAC4HDAC2
SCHEMBL9679255 0.75 SYK (0.48) ABL1ABCB1BCRAPPALDH1A1

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-0855390-A1 A process for producing optically active pyrrolidine derivatives Takasago International Corporation (JP) 1998-07-29 EP disclosed