SCHEMBL16709697

SCHEMBL16709697

C=Cc1ccc(Sc2ccc3ccccc3c2)cc1Sc1ccc2ccccc2c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
KDM4E B2RXH2 2/20 0.40
MAPT P10636 2/20 0.40
PKM P14618 2/20 0.40
MAPK1 P28482 2/20 0.40
KMT2A Q03164 2/20 0.40
MCL1 Q07820 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
MAP2K2 P36507 2/20 0.38
MAP2K1 Q02750 2/20 0.38
HAO1 Q9UJM8 1/20 0.38
SIRT2 Q8IXJ6 1/20 0.37
SIRT1 Q96EB6 1/20 0.37
SIRT3 Q9NTG7 1/20 0.37
RHEB Q15382 1/20 0.36
EGFR P00533 2/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
TP53 P04637 1/20 0.35

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
SCHEMBL16709659 0.95 LMNA (0.40) LMNASMN1; SMN2KDM4EMAPTPKM
SCHEMBL16709709 0.95 LMNA (0.40) LMNASMN1; SMN2KDM4EMAPTPKM
SCHEMBL3684095 0.88 PTGER3 (0.43) LMNASMN1; SMN2KDM4EMAPTPKM
SCHEMBL16709696 0.86 MAOA (0.41) LMNAKDM4EMAPTMAPK1KMT2A
SCHEMBL16709764 0.83 LMNA (0.41) LMNASMN1; SMN2KDM4EMAPTPKM
SCHEMBL16709701 0.77 SLC6A4 (0.36) ALDH1A1CYP1A2
SCHEMBL761802 0.77 LMNA (0.57) LMNASMN1; SMN2KDM4EMAPTPKM
SCHEMBL30832956 0.77 LMNA (0.57) LMNASMN1; SMN2KDM4EMAPTPKM
SCHEMBL16709761 0.77 SMN1; SMN2 (0.44) LMNASMN1; SMN2KDM4EMAPTPKM
SCHEMBL30548745 0.75 MAP2K2 (0.48) LMNASMN1; SMN2MAP2K2MAP2K1HAO1

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
WO-2015068839-A1 POLYMERIZABLE COMPOUND, RESIN COMPOSITION USING SAME, CURED RESIN, AND OPTICAL MATERIAL 新日鉄住金化学株式会社 2015-05-14 WO disclosed