SCHEMBL6444749

SCHEMBL6444749

CCCCN(CCCC)c1ccc(N(c2ccc(N(CC)CC)cc2)c2ccc(N(CC)CC)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.50
PSMD14 O00487 1/20 0.50
CYP3A4 P08684 1/20 0.50
TSHR P16473 1/20 0.50
MAPK1 P28482 1/20 0.50
RECQL P46063 1/20 0.50
GFER P55789 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
ALDH3A1 P30838 1/20 0.47
ALDH1A3 P47895 1/20 0.47
EGFR P00533 1/20 0.44
ERBB2 P04626 1/20 0.44
CNR2 P34972 10/20 0.43
KDM4E B2RXH2 1/20 0.41
GAA P10253 1/20 0.41
CHRM2 P08172 1/20 0.40
CHRM4 P08173 1/20 0.40
CHRM5 P08912 1/20 0.40
CHRM1 P11229 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
SCHEMBL2948653 1.00 ALDH1A1 (0.50) ALDH1A1PSMD14CYP3A4TSHRMAPK1
SCHEMBL2014159 0.93 EGFR (0.47) ALDH1A1PSMD14CYP3A4TSHRMAPK1
SCHEMBL768272 0.93 EGFR (0.47) ALDH1A1PSMD14CYP3A4TSHRMAPK1
SCHEMBL17663681 0.93 EGFR (0.47) ALDH1A1PSMD14CYP3A4TSHRMAPK1
SCHEMBL7153351 0.89 EGFR (0.50) ALDH1A1PSMD14CYP3A4TSHRMAPK1
SCHEMBL4222294 0.86 EGFR (0.42) ALDH1A1PSMD14CYP3A4TSHRMAPK1
SCHEMBL4447508 0.86 EGFR (0.42) ALDH1A1PSMD14CYP3A4TSHRMAPK1
SCHEMBL17660035 0.85 EGFR (0.42) ALDH1A1TSHREGFRERBB2CNR2
SCHEMBL17431102 0.85 CNR2 (0.49) ALDH1A1CYP3A4TSHRGFERTDP1
SCHEMBL15682788 0.85 EGFR (0.42) ALDH1A1TSHREGFRERBB2CNR2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6950228-B2 Electro-optic reflective modulators OPTODOT CORPORATION (US) 2005-09-27 US disclosed
US-20040165245-A1 Electro-optic reflective modulators CARLSON STEVEN ALLEN (US) 2004-08-26 US disclosed
US-20040165246-A1 Electro-optic modulators CARLSON STEVEN ALLEN (US) 2004-08-26 US disclosed