SCHEMBL8772656

SCHEMBL8772656

CCCCCCCCCOc1c(OC)cc(C=O)cc1OC

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ FDPS P14324 1/20 0.49
▸ SRC P12931 1/20 0.46
▸ HTR1A P08908 2/20 0.46
▸ HTR2C P28335 2/20 0.46
▸ HTR2A P28223 1/20 0.46
▸ SLC6A4 P31645 1/20 0.46
▸ HTR7 P34969 1/20 0.46
▸ HTR6 P50406 1/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ THRB P10828 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ MAPK1 P28482 1/20 0.46

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
SCHEMBL7829405 1.00 FDPS (0.49) FDPSSRCHTR1AHTR2CHTR2A
SCHEMBL9122728 1.00 FDPS (0.49) FDPSSRCHTR1AHTR2CHTR2A
SCHEMBL7462173 0.98 FDPS (0.50) FDPSSRCMEN1THRBKMT2A
SCHEMBL7462928 0.93 FDPS (0.51) FDPSSRCMEN1KMT2AALDH1A1
SCHEMBL6739941 0.93 FDPS (0.54) FDPSALDH1A1MAPK1
SCHEMBL8615157 0.93 FDPS (0.54) FDPSALDH1A1MAPK1
SCHEMBL3841589 0.91 S1PR2 (0.52) FDPSHTR1AHTR2CHTR2ASLC6A4
SCHEMBL8772739 0.91 HTR1A (0.50) FDPSHTR1AHTR2CHTR2ASLC6A4
SCHEMBL1201617 0.90 FDPS (0.44) FDPSMEN1THRBKMT2AALDH1A1
SCHEMBL1201339 0.90 FDPS (0.44) FDPSMEN1THRBKMT2AALDH1A1

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
EP-0801071-A1 LEWIS X DERIVATIVE AND PROCESS FOR PRODUCING THE SAME SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1997-10-15 — — EP disclosed
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