SCHEMBL8475352

SCHEMBL8475352

CCCc1[c]c(-c2ccc(C)cc2)c(-c2ccc(C)cc2)c2ccccc12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.36
POLB P06746 1/20 0.36
MAPT P10636 2/20 0.35
ACHE P22303 1/20 0.35
ALDH1A1 P00352 7/20 0.34
TSHR P16473 1/20 0.34
TP53 P04637 3/20 0.33
LMNA P02545 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
HTT P42858 1/20 0.33
L3MBTL1 Q9Y468 2/20 0.32
SMN1; SMN2 Q16637 3/20 0.32
ADORA3 P0DMS8 1/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 2/20 0.31
CTDSP1 Q9GZU7 1/20 0.31
GSK3B P49841 1/20 0.31
ADK P55263 1/20 0.31
GAA P10253 1/20 0.31
PTGS2 P35354 1/20 0.31

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
SCHEMBL8479476 0.89 KDM4E (0.36) KMT2AMAPTACHEALDH1A1LMNA
SCHEMBL8478725 0.87 TP53 (0.35) KMT2AACHEALDH1A1TSHRTP53
SCHEMBL8474843 0.84 KDM4E (0.39) KMT2APOLBMAPTACHEALDH1A1
SCHEMBL8480167 0.76 ALDH1A1 (0.33) ALDH1A1SMN1; SMN2GAA
SCHEMBL8478228 0.76 MAPK1 (0.35) KMT2AMAPTL3MBTL1KDM4EPTGS2
SCHEMBL8480800 0.76 ACHE (0.35) KMT2AMAPTACHEALDH1A1TSHR
SCHEMBL8480989 0.75 DPP4 (0.32) ALDH1A1SMN1; SMN2GAA
SCHEMBL8477575 0.74 PDE4B (0.40) GAA
SCHEMBL8482102 0.72 GCGR (0.32) ALDH1A1SMN1; SMN2GAA
SCHEMBL8481466 0.71 PDE4B (0.36) GAA

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
US-6004988-A Carboxylic acid derivatives, their preparation and their use BASF AKTIENGESELLSCHAFT (DE) 1999-12-21 US disclosed