SCHEMBL28034352

SCHEMBL28034352

CCCCCCCCCCCCCCCCCCNOCc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.51
CETP P11597 3/20 0.47
HRAS P01112 1/20 0.45
HPGD P15428 2/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
NAAA Q02083 1/20 0.44
DNM1 Q05193 1/20 0.42
ALDH1A1 P00352 1/20 0.41
EPHX2 P34913 1/20 0.41

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
SCHEMBL9781675 1.00 SIGMAR1 (0.51) SIGMAR1CETPHRASHPGDMEN1
SCHEMBL12802756 1.00 SIGMAR1 (0.51) SIGMAR1CETPHRASHPGDMEN1
SCHEMBL9775285 1.00 SIGMAR1 (0.51) SIGMAR1CETPHRASHPGDMEN1
SCHEMBL8893077 1.00 SIGMAR1 (0.51) SIGMAR1CETPHRASHPGDMEN1
SCHEMBL28034249 1.00 SIGMAR1 (0.51) SIGMAR1CETPHRASHPGDMEN1
SCHEMBL27753131 0.98 SIGMAR1 (0.53) SIGMAR1CETPHRASHPGDMEN1
Hydrochloric Acid SCHEMBL7870266 0.91 SIGMAR1 (0.44) SIGMAR1CETPHRASHPGDMEN1
SCHEMBL437919 0.91 MAOA (0.48) SIGMAR1HRAS
SCHEMBL1240611 0.85 HRAS (0.46) SIGMAR1HRASALDH1A1
SCHEMBL8863637 0.82 MAOA (0.47) SIGMAR1HRAS

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
CN-105082707-A Production of fibre composite component part based on aluminium and polyurethane EVONIK INDUSTRIES AG 2015-11-25 CN disclosed
CN-105082665-A PRODUCTION OF FIBRE COMPOSITE COMPONENT PART BASED ON STEEL AND POLYURETHANE EVONIK INDUSTRIES AG 2015-11-25 CN disclosed