SCHEMBL18604165

SCHEMBL18604165

CCCCCCCCCC[P+](CC)(CC)CC.CCCCCCCCCC[P+](CC)(CC)CC.CCCCCCCCCC[P+](CC)(CC)CC.CCCCCCCCCC[P+](CC)(CC)CC.CCCCCCCCCC[P+](CC)(CC)CC.CCCCCCCCCC[P+](CC)(CC)CC.CCCCCCCCCC[P+](CC)(CC)CC.CCCCCCCCCC[P+](CC)(CC)CC.N#CB([O-])[O-].N#CB([O-])[O-].N#CB([O-])[O-].N#CB([O-])[O-]

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 2/20 0.48
TSHR P16473 2/20 0.34
THRB P10828 1/20 0.32
GGPS1 O95749 2/20 0.32
BDKRB2 P30411 3/20 0.32
LMNA P02545 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
SCHEMBL18604044 1.00 DNM1 (0.48) DNM1TSHRTHRBGGPS1BDKRB2
SCHEMBL1469247 0.92 DNM1 (0.58) DNM1TSHRTHRBBDKRB2LMNA
SCHEMBL2837715 0.83 DNM1 (0.50) DNM1TSHRBDKRB2
Thiocyanic Acid SCHEMBL3774627 0.81 DNM1 (0.54) DNM1TSHRTHRBGGPS1BDKRB2
SCHEMBL30616360 0.80 DNM1 (0.72) DNM1TSHRTHRBBDKRB2LMNA
SCHEMBL30616361 0.80 DNM1 (0.72) DNM1TSHRTHRBBDKRB2LMNA
SCHEMBL30698151 0.80 DNM1 (0.72) DNM1TSHRTHRBBDKRB2LMNA
SCHEMBL30698143 0.80 DNM1 (0.72) DNM1TSHRTHRBBDKRB2LMNA
SCHEMBL31125177 0.80 DNM1 (0.72) DNM1TSHRTHRBBDKRB2LMNA
SCHEMBL30698153 0.80 DNM1 (0.72) DNM1TSHRTHRBBDKRB2LMNA

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
US-10465303-B2 Producing system of reduction product KABUSHIKI KAISHA TOSHIBA (JP) 2019-11-05 US disclosed
US-20170073827-A1 PRODUCING SYSTEM OF REDUCTION PRODUCT KABUSHIKI KAISHA TOSHIBA (JP) 2017-03-16 US disclosed