SCHEMBL8960014

SCHEMBL8960014

C=C=C1OCc2cc(C)ccc21

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 2/20 0.39
LMNA P02545 2/20 0.35
ALDH1A1 P00352 2/20 0.35
PARP10 Q53GL7 1/20 0.34
PARP11 Q9NR21 1/20 0.34
GAA P10253 2/20 0.33
MAPT P10636 2/20 0.33
CYP3A4 P08684 1/20 0.32
MAOA P21397 2/20 0.31
MAOB P27338 2/20 0.31
KDM4E B2RXH2 1/20 0.31
POLB P06746 1/20 0.31
PKM P14618 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MMP12 P39900 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
SCHEMBL8960053 0.78 KCNJ1 (0.36) LMNAALDH1A1GAAMAPTMAOA
SCHEMBL8959782 0.78 LMNA (0.38) LMNAGAAMAPT
SCHEMBL8960183 0.76 KCNJ1 (0.40)
SCHEMBL8959917 0.74 MAOA (0.42) ALDH1A1MAPTMAOAMAOBPOLB
SCHEMBL8960058 0.72 MEN1 (0.42) ALDH1A1GAAMAPTMAOAMAOB
SCHEMBL8960097 0.72 GPR3 (0.39) LMNAALDH1A1CYP3A4KDM4E
SCHEMBL2708372 0.72 CYP19A1 (0.41) METAP1LMNAALDH1A1PARP10PARP11
SCHEMBL6995518 0.72 LMNA (0.62) METAP1LMNAALDH1A1PARP10PARP11
SCHEMBL8960023 0.71 GPR3 (0.41) LMNAALDH1A1CYP3A4KDM4E
SCHEMBL8960101 0.71 GPR3 (0.41) LMNAALDH1A1CYP3A4KDM4E

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-5510456-A Bridged cyclic arleneethylene polymers SHOWA DENKO K. K. (JP) 1996-04-23 US disclosed