SCHEMBL8894856

SCHEMBL8894856

CCCC[CH]C(=O)OCC1CCCC1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.40
CYP1A2 P05177 1/20 0.37
NAAA Q02083 2/20 0.36
ATM Q13315 1/20 0.35
CTSL P07711 1/20 0.34
CTSB P07858 1/20 0.34
CTSK P43235 1/20 0.34

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
SCHEMBL8893475 0.98 LMNA (0.42) LMNACYP1A2NAAAATMCTSL
SCHEMBL8895316 0.98 LMNA (0.42) LMNACYP1A2NAAAATMCTSL
SCHEMBL8896684 0.95 LMNA (0.39) LMNACYP1A2NAAA
SCHEMBL8895044 0.94 NAAA (0.41) LMNANAAA
SCHEMBL8894486 0.94 NAAA (0.41) LMNANAAA
SCHEMBL8896041 0.94 LMNA (0.41) LMNACYP1A2NAAA
SCHEMBL8893861 0.94 LMNA (0.41) LMNACYP1A2NAAA
SCHEMBL8893461 0.94 NAAA (0.41) LMNANAAA
SCHEMBL8896770 0.94 NAAA (0.41) LMNANAAA
SCHEMBL8893387 0.94 NAAA (0.41) LMNANAAA

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