SCHEMBL17565196

SCHEMBL17565196

CCC(C)(C)c1cc(C)cc(C(c2ccc(OC)cc2)c2cc(C)cc(C)c2OCCO)c1OCCO

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 2/20 0.34
DRD2 P14416 1/20 0.34
HTR2A P28223 1/20 0.34
HTR7 P34969 1/20 0.34
ADRA1A P35348 1/20 0.34
BRD4 O60885 1/20 0.31
CYP3A4 P08684 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL17565200 0.89 HTR1A (0.33) HTR1ABRD4
SCHEMBL17549776 0.81 HTR1A (0.39) HTR1ACYP3A4
SCHEMBL17565182 0.80 KDM4E (0.36) HTR1A
SCHEMBL17565190 0.78 HTR1A (0.34) HTR1ACYP3A4
SCHEMBL17565197 0.75 HTR1A (0.40) HTR1AHTR2AHTR7ADRA1ABRD4
SCHEMBL17565213 0.74 HTR1A (0.39) HTR1ACYP3A4SMN1; SMN2
SCHEMBL17565189 0.72 HSPA5 (0.38) HTR1ACYP3A4SMN1; SMN2
SCHEMBL17565188 0.71 HTR1A (0.37) HTR1ACYP3A4SMN1; SMN2
SCHEMBL17565179 0.70 HTR1A (0.41) HTR1ACYP3A4SMN1; SMN2
SCHEMBL17565208 0.70 HTR1A (0.34) HTR1AHTR2AHTR7ADRA1ACYP3A4

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-20160071992-A1 BACK SHEET FOR SOLAR CELLS AND SOLAR CELL MODULE FUJIFILM CORPORATION (JP) 2016-03-10 US disclosed