SCHEMBL8376169

SCHEMBL8376169

BrCCC[P+](c1ccccc1)(c1ccccc1)c1ccccc1.BrCCC[P+](c1ccccc1)(c1ccccc1)c1ccccc1.O=[Mn](=O)(O)Br.O=[Mn](=O)(O)Br.O=[Mn](=O)([O-])Br.O=[Mn](=O)([O-])Br

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 1/20 0.44
ALDH1A1 P00352 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2D6 P10635 1/20 0.43
TSHR P16473 1/20 0.43
CYP2C19 P33261 1/20 0.43
CHRNA7 P36544 8/20 0.34
TRAP1 Q12931 3/20 0.33
PTPN1 P18031 1/20 0.32
GSK3B P49841 1/20 0.32

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
SCHEMBL8374664 0.95 HIF1A (0.42) HIF1AALDH1A1CYP1A2CYP2D6TSHR
Butyltriphenylphosphonium SCHEMBL8374675 0.86 HIF1A (0.42) HIF1AALDH1A1CYP1A2CYP2D6TSHR
SCHEMBL8376141 0.83 HIF1A (0.47) HIF1AALDH1A1CYP1A2CYP2D6TSHR
SCHEMBL8374778 0.83 ALDH1A1 (0.40) HIF1AALDH1A1CYP1A2CYP2D6TSHR
SCHEMBL8379553 0.83 ALDH1A1 (0.40) HIF1AALDH1A1CYP1A2CYP2D6TSHR
SCHEMBL8375327 0.83 ALDH1A1 (0.40) HIF1AALDH1A1CYP1A2CYP2D6TSHR
SCHEMBL8376852 0.83 ALDH1A1 (0.40) HIF1AALDH1A1CYP1A2CYP2D6TSHR
Decyltriphenylphosphonium SCHEMBL8378820 0.83 ALDH1A1 (0.40) HIF1AALDH1A1CYP1A2CYP2D6TSHR
SCHEMBL8378714 0.83 ALDH1A1 (0.40) HIF1AALDH1A1CYP1A2CYP2D6TSHR
SCHEMBL29833528 0.82 HIF1A (0.64) HIF1AALDH1A1CYP1A2CYP2D6TSHR

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0718706-B1 Bis(quaternary phosphonium) tetrahalomanganate salts as charge-control agents EASTMAN KODAK CO (US) 1999-03-17 EP disclosed
EP-0718706-A1 Bis(quaternary phosphonium) tetrahalomanganate salts as charge-control agents EASTMAN KODAK COMPANY (US) 1996-06-26 EP disclosed
US-5512407-A Bis(quaternary phosphonium) tetrahalomanganate salts as charge-control agents EASTMAN KODAK COMPANY (US) 1996-04-30 US disclosed