SCHEMBL9100255

SCHEMBL9100255

CCCCCCCCCCCC(O)S(=O)(=O)c1ccc(C=Cc2ccc(N(CCCC)CCCC)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ INSR P06213 1/20 0.42
▸ CHRM2 P08172 1/20 0.41
▸ CHRM4 P08173 1/20 0.41
▸ CHRM5 P08912 1/20 0.41
▸ CHRM1 P11229 1/20 0.41
▸ CHRM3 P20309 1/20 0.41
▸ ATG4B Q9Y4P1 1/20 0.39
▸ MMP9 P14780 3/20 0.39
▸ MMP13 P45452 3/20 0.39
▸ ADAM17 P78536 3/20 0.39
▸ MMP1 P03956 2/20 0.39
▸ CNR2 P34972 6/20 0.39
▸ MMP2 P08253 1/20 0.38
▸ MMP3 P08254 1/20 0.38
▸ KDM4A O75164 2/20 0.37
▸ KDM2A Q9Y2K7 2/20 0.37
▸ AR P10275 1/20 0.35
▸ NR1I2 O75469 1/20 0.34

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
SCHEMBL9103150 1.00 INSR (0.42) INSRCHRM2CHRM4CHRM5CHRM1
SCHEMBL9098540 1.00 INSR (0.42) INSRCHRM2CHRM4CHRM5CHRM1
SCHEMBL9097822 0.99 CHRM2 (0.42) INSRCHRM2CHRM4CHRM5CHRM1
SCHEMBL9415719 0.98 CNR2 (0.41) INSRCHRM2CHRM4CHRM5CHRM1
SCHEMBL9101964 0.93 CHRM2 (0.43) INSRCHRM2CHRM4CHRM5CHRM1
SCHEMBL9099897 0.88 KDM4A (0.50) INSRMMP9MMP13ADAM17MMP1
SCHEMBL9098502 0.80 MMP9 (0.49) MMP9MMP13ADAM17MMP1MMP2
SCHEMBL9099798 0.80 MMP9 (0.49) MMP9MMP13ADAM17MMP1MMP2
SCHEMBL9104245 0.80 MMP9 (0.49) MMP9MMP13ADAM17MMP1MMP2
SCHEMBL9100262 0.80 MMP9 (0.49) MMP9MMP13ADAM17MMP1MMP2

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-5517350-A Optical component based on Langmuir-Blodgett layers HOECHST AKTIENGESELLSCHAFT (DE) 1996-05-14 — — US disclosed
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