SCHEMBL8084635

SCHEMBL8084635

CCCCN(CCCC)c1ccccc1C(O)(c1ccccc1)c1ccccc1N(CCCC)CCCC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 3/20 0.43
NR1H3 Q13133 3/20 0.43
ESR2 Q92731 1/20 0.39
CRHBP P24387 1/20 0.39
CRHR2 Q13324 1/20 0.39
SIGMAR1 Q99720 1/20 0.39
CHRM2 P08172 1/20 0.36
CHRM4 P08173 1/20 0.36
CHRM5 P08912 1/20 0.36
CHRM1 P11229 1/20 0.36
CHRM3 P20309 1/20 0.36
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
ADRA1A P35348 1/20 0.36
OPRK1 P41145 1/20 0.36
KCNH2 Q12809 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
TDP1 Q9NUW8 1/20 0.35
LMNA P02545 2/20 0.35
OPRM1 P35372 1/20 0.35

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
SCHEMBL27669800 0.80 CRHBP (0.46) NR1H2NR1H3CRHBPCRHR2SIGMAR1
SCHEMBL599438 0.78 NR1H2 (0.58) NR1H2NR1H3ESR2ALDH1A1
SCHEMBL8958180 0.76 ALDH1A1 (0.44) KCNH2ALDH1A1
SCHEMBL7153352 0.75 TDP1 (0.44) NR1H2NR1H3KCNH2TDP1LMNA
Potassium Ion SCHEMBL8957905 0.75 NR1H2 (0.35) NR1H2NR1H3ESR2SMN1; SMN2TDP1
SCHEMBL6550713 0.71 ESR1 (0.44) NR1H2NR1H3KCNH2IDO1ALDH1A1
SCHEMBL1836555 0.71 LMNA (0.47) NR1H2NR1H3OPRK1TDP1LMNA
SCHEMBL30525531 0.71 LMNA (0.47) NR1H2NR1H3OPRK1TDP1LMNA
SCHEMBL9419764 0.70 TDP1 (0.40) NR1H2NR1H3KCNH2TDP1LMNA
Potassium Ion SCHEMBL8957909 0.70 ALDH1A1 (0.41) LMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6087072-A Article having a light-controllable super-water-repellent surface and a printing machine using the article HITACHI, LTD. (JP) 2000-07-11 US disclosed
US-6027852-A Article having a light-controllable super-water-repellent surface and a printing machine using the article HITACHI, LTD. (JP) 2000-02-22 US disclosed