SCHEMBL6941692

SCHEMBL6941692

Cc1ccc(CO)cc1C1C2CC3CC(C2)CC1(CC(N)=O)C3

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
STS P08842 1/20 0.34
P2RX7 Q99572 3/20 0.33
LMNA P02545 3/20 0.32
CNR1 P21554 1/20 0.32
CNR2 P34972 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
POLB P06746 1/20 0.32
HSD11B1 P28845 3/20 0.32
ABCB11 O95342 1/20 0.32
RAB9A P51151 2/20 0.31
EPHX2 P34913 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
ABL1 P00519 1/20 0.30

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
SCHEMBL6942683 0.79 ALDH1A1 (0.40) P2RX7SMN1; SMN2EPHX2MEN1KMT2A
SCHEMBL6945341 0.74 P2RX7 (0.34) P2RX7LMNACNR2SMN1; SMN2HSD11B1
SCHEMBL6941696 0.72 P2RX7 (0.40) P2RX7EPHX2MEN1KMT2A
SCHEMBL6943637 0.72 P2RX7 (0.48) P2RX7CNR2SMN1; SMN2POLBHSD11B1
SCHEMBL6941247 0.64 P2RX7 (0.69) P2RX7ABCB11
SCHEMBL28144676 0.64 ALDH1A1 (0.39) LMNAHSD11B1RAB9AMEN1KMT2A
SCHEMBL11858437 0.63 ALDH1A1 (0.38) LMNAHSD11B1RAB9AEPHX2MEN1
SCHEMBL16956564 0.62 SLC6A2 (0.40) ABL1
SCHEMBL6680351 0.62 EPHX2 (0.41) P2RX7LMNASMN1; SMN2POLBHSD11B1
SCHEMBL8104812 0.61 HSP90AA1 (0.37) P2RX7CNR2EPHX2MEN1KMT2A

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-1036058-B1 ADAMANTANE DERIVATIVES ASTRAZENECA UK LTD (GB) 2003-03-12 EP claimed