SCHEMBL10657247

SCHEMBL10657247

CCCCCCC[C@H]1CC[C@@H]([C@H]2CC[C@H](CCC(C)CCCC(C)C)CC2)CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.47
LMNA P02545 2/20 0.39
TP53 P04637 1/20 0.38
PRKD3 O94806 1/20 0.36
PRKCG P05129 1/20 0.36
PRKCB P05771 1/20 0.36
PRKCA P17252 1/20 0.36
PRKCH P24723 1/20 0.36
PRKCI P41743 1/20 0.36
PRKCE Q02156 1/20 0.36
PRKCQ Q04759 1/20 0.36
PRKCZ Q05513 1/20 0.36
PRKCD Q05655 1/20 0.36
PRKD1 Q15139 1/20 0.36
CYP1A2 P05177 1/20 0.35
LSS P48449 2/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
HTT P42858 2/20 0.34
ACE2 Q9BYF1 1/20 0.33

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
SCHEMBL10657254 1.00 MAPT (0.47) MAPTLMNATP53PRKD3PRKCG
SCHEMBL10657244 1.00 MAPT (0.47) MAPTLMNATP53PRKD3PRKCG
SCHEMBL10657252 1.00 MAPT (0.47) MAPTLMNATP53PRKD3PRKCG
SCHEMBL11372817 0.83 LMNA (0.56) MAPTLMNAMEN1KMT2APTPN1
SCHEMBL17681484 0.81 CYP1A2 (0.46) MAPTLMNATP53CYP1A2LSS
SCHEMBL10485974 0.79 CYP1A2 (0.52) LMNATP53CYP1A2LSSMEN1
SCHEMBL10706195 0.79 CYP1A2 (0.52) LMNATP53CYP1A2LSSMEN1
SCHEMBL8216620 0.79 CYP1A2 (0.52) LMNATP53CYP1A2LSSMEN1
SCHEMBL10486024 0.79 CYP1A2 (0.52) LMNATP53CYP1A2LSSMEN1
SCHEMBL10702696 0.79 CYP1A2 (0.52) LMNATP53CYP1A2LSSMEN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0257048-A1 OPTICALLY ACTIVE COMPOUNDS. MERCK PATENT GMBH (DE) 1988-03-02 EP disclosed
WO-1987005018-A2 OPTICALLY ACTIVE COMPOUNDS MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1987-08-27 WO disclosed