SCHEMBL8293201

SCHEMBL8293201

Cc1ccc(O)c(Cn2c(NC3CCNCC3)nc3ccc(CCN)cc32)n1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SOS1 Q07889 1/20 0.52
KCNH2 Q12809 10/20 0.49
NR4A2 P43354 2/20 0.49
SSTR5 P35346 6/20 0.38
LMNA P02545 2/20 0.37
GAA P10253 2/20 0.37
ALDH1A1 P00352 1/20 0.37
MEN1 O00255 1/20 0.37
MLNR O43193 1/20 0.37
CACNA1F O60840 1/20 0.37
EED O75530 1/20 0.37
USP2 O75604 1/20 0.37
ABCB11 O95342 1/20 0.37
EGFR P00533 1/20 0.37
HLA-A P04439 1/20 0.37
ERBB2 P04626 1/20 0.37
TP53 P04637 1/20 0.37
CYP1A2 P05177 1/20 0.37
LCK P06239 1/20 0.37
FYN P06241 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
SCHEMBL8284432 0.90 SOS1 (0.52) SOS1KCNH2NR4A2SSTR5LMNA
SCHEMBL12852045 0.89 SOS1 (0.48) SOS1KCNH2NR4A2SSTR5LMNA
SCHEMBL8292655 0.87 KCNH2 (0.47) SOS1KCNH2NR4A2SSTR5LMNA
SCHEMBL12909078 0.84 KCNH2 (0.43) SOS1KCNH2NR4A2SSTR5LMNA
SCHEMBL12852035 0.83 SSTR5 (0.53) KCNH2NR4A2SSTR5LMNAGAA
SCHEMBL8292656 0.83 KCNH2 (0.46) KCNH2NR4A2SSTR5LMNAGAA
SCHEMBL8292651 0.83 KCNH2 (0.41) KCNH2NR4A2SSTR5LMNAGAA
Hydrochloric Acid SCHEMBL1238370 0.82 KCNH2 (0.45) KCNH2NR4A2SSTR5LMNAGAA
Hydrochloric Acid SCHEMBL1236013 0.82 SSTR5 (0.53) KCNH2NR4A2SSTR5LMNAGAA
SCHEMBL8293606 0.81 SOS1 (0.45) SOS1KCNH2NR4A2LMNAGAA

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-2005058874-A1 5- OR 6-SUBSTITUTED BENZIMIDAZOLE DERIVATIVES AS INHIBITORS OF RESPIRATORY SYNCYTIAL VIRUS REPLICATION TIBOTEC PHARMACEUTICALS LTD. (IE) 2005-06-30 WO disclosed