SCHEMBL27655228

SCHEMBL27655228

Cc1ccc(F)c(C#CCN2CCN(C(=O)O)CC2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.42
▸ MAPK1 P28482 2/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ KDM4E B2RXH2 4/20 0.37
▸ ALDH1A1 P00352 4/20 0.37
▸ HTT P42858 2/20 0.37
▸ AURKA O14965 1/20 0.37
▸ MAP4K4 O95819 1/20 0.37
▸ ABL1 P00519 1/20 0.37
▸ NTRK1 P04629 1/20 0.37
▸ LCK P06239 1/20 0.37
▸ FYN P06241 1/20 0.37
▸ CSF1R P07333 1/20 0.37
▸ RET P07949 1/20 0.37
▸ MET P08581 1/20 0.37
▸ PDGFRB P09619 1/20 0.37
▸ PIM1 P11309 1/20 0.37
▸ FGFR1 P11362 1/20 0.37
▸ PDGFRA P16234 1/20 0.37
▸ FLT1 P17948 1/20 0.37

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
SCHEMBL5710903 0.87 ALDH1A1 (0.50) LMNAKDM4EALDH1A1MEN1KMT2A
SCHEMBL27655162 0.86 LMNA (0.43) LMNAMAPK1RAB9AKDM4EALDH1A1
SCHEMBL5710843 0.74 HRH1 (0.49) KDM4EALDH1A1GRM5
SCHEMBL2474221 0.71 LMNA (0.76) LMNAMAPK1RAB9AALDH1A1MEN1
SCHEMBL27675025 0.69 RAB9A (0.56) LMNAMAPK1RAB9AKDM4EALDH1A1
SCHEMBL25380612 0.69 FFAR1 (0.38) LMNARAB9AALDH1A1HTTMEN1
SCHEMBL17676107 0.68 ALDH1A1 (0.46) LMNAMAPK1RAB9AKDM4EALDH1A1
SCHEMBL21386081 0.68 NFE2L2 (0.32) RAB9ASMN1; SMN2MAPT
SCHEMBL22462777 0.68 KDM1A (0.37) MEN1KMT2A
SCHEMBL27664371 0.67 MAPT (0.54) LMNAMAPK1KDM4EALDH1A1HTT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1934097-A Acetylinic piperazine compounds and their use as metabotropic glutamate receptor antagonists ASTRAZENECA AB (SE) 2007-03-21 — — CN claimed
CN-1934097-A Acetylinic piperazine compounds and their use as metabotropic glutamate receptor antagonists ASTRAZENECA AB (SE) 2007-03-21 — — CN disclosed
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