SCHEMBL8894746

SCHEMBL8894746

CCCCCCC[CH]C(=O)OC(C)C1CCCCCC1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.42
NAAA Q02083 3/20 0.41
EPHX1 P07099 9/20 0.39
EPHX2 P34913 2/20 0.39
LMNA P02545 2/20 0.39
CNR2 P34972 1/20 0.38
CTSL P07711 1/20 0.36
CTSB P07858 1/20 0.36
CTSK P43235 1/20 0.36

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
SCHEMBL8895539 1.00 TSHR (0.42) TSHRNAAAEPHX1EPHX2LMNA
SCHEMBL8895127 1.00 TSHR (0.42) TSHRNAAAEPHX1EPHX2LMNA
SCHEMBL8893905 1.00 TSHR (0.42) TSHRNAAAEPHX1EPHX2LMNA
SCHEMBL8894879 1.00 TSHR (0.42) TSHRNAAAEPHX1EPHX2LMNA
SCHEMBL8894758 1.00 TSHR (0.42) TSHRNAAAEPHX1EPHX2LMNA
SCHEMBL8896202 1.00 TSHR (0.42) TSHRNAAAEPHX1EPHX2LMNA
SCHEMBL8897575 1.00 TSHR (0.42) TSHRNAAAEPHX1EPHX2LMNA
SCHEMBL8896613 0.98 LMNA (0.40) TSHRNAAAEPHX1EPHX2LMNA
SCHEMBL8894011 0.98 TSHR (0.40) TSHRNAAAEPHX1EPHX2LMNA
SCHEMBL8896256 0.98 LMNA (0.40) TSHRNAAAEPHX1EPHX2LMNA

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-5670563-A ORGANOTIN COMPOUND, PHOSPHORUS COMPOUND CIBA-SPECIALTY CHEMICALS CORPORATION (US) 1997-09-23 US disclosed