SCHEMBL5306559

SCHEMBL5306559

COc1ccc(CNc2cc(-c3ccc(-c4ccc(C)c(C)c4)cc3)nn2C)cc1OC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.47
ALDH1A1 P00352 4/20 0.47
KMT2A Q03164 4/20 0.47
MAPT P10636 4/20 0.47
TDP1 Q9NUW8 3/20 0.47
LMNA P02545 3/20 0.47
HPGD P15428 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
POLB P06746 2/20 0.43
GAA P10253 6/20 0.43
RAB9A P51151 2/20 0.43
HSD17B10 Q99714 1/20 0.41
TSHR P16473 2/20 0.41
MEN1 O00255 3/20 0.40
HTT P42858 2/20 0.40
NPC1 O15118 2/20 0.39
ALOX15 P16050 1/20 0.39
MAPK1 P28482 1/20 0.39
GFER P55789 1/20 0.39
TP53 P04637 1/20 0.39

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
SCHEMBL5303090 0.87 MAPT (0.51) KDM4EALDH1A1MAPTLMNAHPGD
SCHEMBL10119764 0.85 KDM4E (0.55) KDM4EALDH1A1KMT2AMAPTTDP1
SCHEMBL5303639 0.84 LMNA (0.44) KDM4EALDH1A1KMT2AMAPTLMNA
SCHEMBL5306369 0.84 TP53 (0.48) KDM4EALDH1A1KMT2AMAPTHPGD
SCHEMBL5307225 0.83 MAPT (0.48) KDM4EALDH1A1KMT2AMAPTTDP1
SCHEMBL5304358 0.82 MAPT (0.45) KMT2AMAPTTDP1L3MBTL1POLB
SCHEMBL5306328 0.82 F2 (0.47) KDM4EALDH1A1KMT2AMAPTTDP1
SCHEMBL5310087 0.81 CYP1A2 (0.44) KDM4EALDH1A1KMT2AMAPTTDP1
SCHEMBL5304392 0.81 CYP1A2 (0.45) ALDH1A1KMT2AMAPTLMNAHPGD
SCHEMBL5306913 0.81 CDK2 (0.40) KDM4EALDH1A1MAPTTDP1POLB

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
WO-2007034279-A2 C3A ANTAGONISTS AND PHARMACEUTICAL COMPOSITIONS THEREOF PFIZER PRODUCTS INC. (US) 2007-03-29 WO claimed