SCHEMBL8635501

SCHEMBL8635501

CCCC(CC)C(C)(C)O

nearest known ligand 0.33

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.33
LMNA P02545 1/20 0.32
CA2 P00918 3/20 0.31
CA1 P00915 2/20 0.31
MAPK1 P28482 1/20 0.31
CHRM1 P11229 1/20 0.31
AKR1A1 P14550 1/20 0.31
CHRM3 P20309 1/20 0.31
HTR2A P28223 1/20 0.31
HTR2C P28335 1/20 0.31
ADRA1A P35348 1/20 0.31
HRH1 P35367 1/20 0.31
DRD3 P35462 1/20 0.31
SLC6A3 Q01959 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC2 Q92769 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
FDPS P14324 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
SCHEMBL11915764 0.88 TSHR (0.35) TSHRCHRM1AKR1A1CHRM3HTR2A
SCHEMBL10242782 0.84 FDPS (0.45) TSHRCA2CA1MAPK1TDP1
SCHEMBL2638803 0.83 TSHR (0.33) TSHRLMNACA2CA1MAPK1
SCHEMBL14646058 0.82 FDPS (0.48) LMNACA2CA1MAPK1FDPS
SCHEMBL4389375 0.82
SCHEMBL5931169 0.81 DPP4 (0.42) TSHR
SCHEMBL5931022 0.81 TSHR (0.48) TSHRLMNA
SCHEMBL78074 0.80 FDPS (0.52) LMNACA2FDPS
SCHEMBL22631212 0.80 FDPS (0.52) LMNACA2FDPS
SCHEMBL28150236 0.79 TSHR (0.38) TSHR

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
EP-0623480-B1 Thermal transfer recording sheet MITSUBISHI CHEM CORP (JP) 1998-07-15 EP disclosed
US-5529973-A HAVING HEAT RESISTANT LUBRICATING LAYER CONTAINING THERMOPLASTIC RESIN WITH SPECIFIED GLASS TRANSITION TEMPERATURE, AMINO-MODIFIED SILICONE OIL, CARBOXY-MODIFIED SILICONE OIL MITSUBISHI CHEMICAL CORPORATION (JP) 1996-06-25 US disclosed
EP-0623480-A2 Thermal transfer recording sheet Mitsubishi Chemical Corporation (JP) 1994-11-09 EP disclosed