SCHEMBL4741965

SCHEMBL4741965

CCN(c1ccccc1)c1ncnc2ccc(O)cc12

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 8/20 0.63
CSF1R P07333 7/20 0.63
SMN1; SMN2 Q16637 2/20 0.49
KDM4E B2RXH2 1/20 0.49
NPC1 O15118 1/20 0.49
HPGD P15428 1/20 0.49
RAB9A P51151 1/20 0.49
TP53 P04637 2/20 0.45
HTT P42858 2/20 0.45
ALDH1A1 P00352 1/20 0.45
RET P07949 1/20 0.43
KIF5B P33176 1/20 0.43
KDR P35968 1/20 0.43
PIK3CD O00329 1/20 0.42
LMNA P02545 1/20 0.42
PIK3R1 P27986 1/20 0.42
HIF1A Q16665 1/20 0.42
ERBB2 P04626 1/20 0.41
PDGFRB P09619 1/20 0.40
PDGFRA P16234 1/20 0.40

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
SCHEMBL29058418 0.84 CSF1R (0.63) EGFRCSF1RSMN1; SMN2KDM4ENPC1
SCHEMBL3645660 0.79 CSF1R (0.58) EGFRCSF1RSMN1; SMN2KDM4ENPC1
SCHEMBL4741361 0.79 EGFR (0.82) EGFRCSF1RSMN1; SMN2KDM4ENPC1
Hydrochloric Acid SCHEMBL8808017 0.78 EGFR (0.61) EGFRCSF1RSMN1; SMN2KDM4ENPC1
SCHEMBL8177845 0.77 EGFR (1.00) EGFRCSF1RKDM4EHPGDTP53
SCHEMBL29058819 0.77 CSF1R (0.55) EGFRCSF1RSMN1; SMN2KDM4ENPC1
SCHEMBL30395607 0.77 CSF1R (0.55) EGFRCSF1RSMN1; SMN2KDM4ENPC1
Hydrochloric Acid SCHEMBL6181342 0.76 EGFR (1.00) EGFRCSF1RTP53RETKIF5B
SCHEMBL5499105 0.76 EGFR (0.51) EGFRCSF1RSMN1; SMN2KDM4ENPC1
SCHEMBL11089207 0.76 CSF1R (0.63) EGFRCSF1RSMN1; SMN2KDM4ENPC1

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-2008033747-A9 MULTI-FUNCTIONAL SMALL MOLECULES AS ANTI-PROLIFERATIVE AGENTS CURIS INC (MA) 2008-07-24 WO disclosed