SCHEMBL13635121

SCHEMBL13635121

CC(C)COCCn1c2ccccc2c2ccc(C=O)cc21

nearest known ligand 0.60

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PTGER4 P35408 4/20 0.60
▸ MEN1 O00255 3/20 0.44
▸ KMT2A Q03164 3/20 0.44
▸ APP P05067 2/20 0.38
▸ PTGS2 P35354 1/20 0.38
▸ POLB P06746 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ PSEN1 P49768 4/20 0.37
▸ PSEN2 P49810 4/20 0.37
▸ APH1B Q8WW43 4/20 0.37
▸ NCSTN Q92542 4/20 0.37
▸ APH1A Q96BI3 4/20 0.37
▸ PSENEN Q9NZ42 4/20 0.37
▸ KIF11 P52732 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36

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
SCHEMBL13635119 0.84 PTGER4 (0.73) PTGER4MEN1KMT2AAPPMAPT
SCHEMBL13011247 0.80 KDM4E (0.57) PTGER4MEN1KMT2APSEN1PSEN2
SCHEMBL13634962 0.79 PTGER4 (0.61) PTGER4MEN1KMT2APOLBMAPT
SCHEMBL13635107 0.78 MEN1 (0.47) PTGER4MEN1KMT2APTGS2POLB
SCHEMBL13011160 0.78 SCARB1 (0.50) PTGER4MEN1KMT2APTGS2PSEN1
SCHEMBL28899271 0.77 PTGER4 (0.58) PTGER4PSEN1PSEN2APH1BNCSTN
SCHEMBL13387565 0.77 PTGER4 (0.85) PTGER4MEN1KMT2AAPPPOLB
SCHEMBL30295042 0.77 PTGER4 (0.85) PTGER4MEN1KMT2AAPPPOLB
SCHEMBL12479908 0.77 PTGER4 (0.85) PTGER4MEN1KMT2AAPPPOLB
SCHEMBL7172636 0.76 PTGER4 (0.61) PTGER4MEN1KMT2APOLBMAPT

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-2119704-A1 ACYLGUANIDINE DERIVATIVE Astellas Pharma Inc. (JP) 2009-11-18 — — EP disclosed
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