SCHEMBL4615806

SCHEMBL4615806

CC(C)c1ccc(C(C)C)c(N2[C]SC=C2)c1

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.31
GABRA1 P14867 1/20 0.30
GABRB2 P47870 1/20 0.30
TRPA1 O75762 1/20 0.30
PTGS1 P23219 1/20 0.30
CACNA1C Q13936 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
SCHEMBL1007092 0.73 GABRA1 (0.42) LMNAGABRA1GABRB2PTGS1
SCHEMBL4615808 0.70 LMNA (0.30) LMNA
SCHEMBL2231981 0.69 LMNA (0.38) LMNAGABRA1GABRB2TRPA1PTGS1
SCHEMBL9893452 0.66 GABRA1 (0.41) LMNAGABRA1GABRB2TRPA1PTGS1
SCHEMBL778017 0.64 LMNA (0.46) LMNAGABRA1GABRB2TRPA1PTGS1
SCHEMBL29630154 0.64 LMNA (0.46) LMNAGABRA1GABRB2TRPA1PTGS1
SCHEMBL14200309 0.63 KDM4E (0.42) LMNA
SCHEMBL6124197 0.63 LMNA (0.41) LMNAGABRA1GABRB2TRPA1PTGS1
SCHEMBL14200352 0.62 MAPT (0.43) LMNA
SCHEMBL21508068 0.61 ALDH1A1 (0.49) LMNATRPA1PTGS1CACNA1C

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
EP-1990364-A1 MOLDED CROSSLINKABLE-RESIN OBJECT, MOLDED CROSSLINKED-RESIN OBJECT, AND CROSSLINKED-RESIN/METAL LAMINATE ZEON CORPORATION (JP) 2008-11-12 EP disclosed