SCHEMBL27595288

SCHEMBL27595288

CCCCNc1ccc(C)c(C(=O)O)c1C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM6B O15054 2/20 0.48
KDM4C Q9H3R0 2/20 0.48
HCAR3 P49019 5/20 0.47
GUCY1A1 Q02108 1/20 0.43
GUCY1B1 Q02153 1/20 0.43
CISD1 Q9NZ45 1/20 0.39
PLK1 P53350 2/20 0.38
METAP2 P50579 2/20 0.38
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
LMNA P02545 2/20 0.37
HPGD P15428 2/20 0.37
KDM4E B2RXH2 1/20 0.37
USP2 O75604 1/20 0.37
ALDH1A1 P00352 1/20 0.37
CA2 P00918 1/20 0.37
TSHR P16473 1/20 0.37
BLM P54132 1/20 0.37
SLC12A2 P55011 1/20 0.37
HIF1A Q16665 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
SCHEMBL9690904 0.81 KDM6B (0.46) KDM6BKDM4CHCAR3MAPTKDM4E
SCHEMBL29033346 0.81 KDM6B (0.57) KDM6BKDM4CHCAR3CISD1PLK1
SCHEMBL27498211 0.78 POLB (0.54) GAAMAPTLMNAHPGDKDM4E
SCHEMBL15934301 0.77 KDM6B (0.39) KDM6BKDM4CHCAR3GUCY1A1GUCY1B1
SCHEMBL27736211 0.76 KDM6B (0.52) KDM6BKDM4CHCAR3CISD1PLK1
SCHEMBL14620215 0.76 IDO1 (0.49) KDM6BKDM4CHCAR3CISD1GAA
SCHEMBL28114974 0.76 KDM6B (0.49) KDM6BKDM4CHCAR3CISD1PLK1
SCHEMBL27756887 0.75 PLK1 (0.52) KDM6BKDM4CHCAR3CISD1PLK1
SCHEMBL15412099 0.75 HCAR3 (0.64) KDM6BKDM4CHCAR3PLK1GAA
SCHEMBL27542122 0.75 HCAR3 (0.41) KDM6BKDM4CHCAR3CISD1PLK1

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
CN-1623992-A Novel medicine of non peptide like angiotensin II receptor antagonism agent, their preparation and application UNIV BEIJING NORMAL (CN) 2005-06-08 CN disclosed