SCHEMBL22444529

SCHEMBL22444529

CCCCCCCCC(O)NN

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 2/20 0.50
CYP2D6 P10635 2/20 0.47
LMNA P02545 2/20 0.47
GMNN O75496 1/20 0.47
POLB P06746 1/20 0.47
THPO P40225 1/20 0.47
MTOR P42345 1/20 0.47
BLM P54132 1/20 0.47
KDM4E B2RXH2 1/20 0.47
TP53 P04637 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
MAPT P10636 1/20 0.47
CETP P11597 1/20 0.47
HTT P42858 1/20 0.47
UBE2N P61088 1/20 0.47
GPR84 Q9NQS5 7/20 0.45
FFAR1 O14842 1/20 0.45
OPRM1 P35372 1/20 0.42
LAP3 P28838 1/20 0.42

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
SCHEMBL22444507 1.00 SPHK1 (0.50) SPHK1CYP2D6LMNAGMNNPOLB
SCHEMBL8898626 0.98
SCHEMBL22444443 0.90
SCHEMBL16618484 0.80 GPR84 (0.48) SPHK1CYP2D6LMNAGMNNPOLB
SCHEMBL16618557 0.80 GPR84 (0.48) SPHK1CYP2D6LMNAGMNNPOLB
SCHEMBL9801350 0.80 GPR84 (0.48) SPHK1CYP2D6LMNAGMNNPOLB
SCHEMBL36470 0.80 GPR84 (0.48) SPHK1CYP2D6LMNAGMNNPOLB
SCHEMBL16618515 0.80 GPR84 (0.48) SPHK1CYP2D6LMNAGMNNPOLB
SCHEMBL9801711 0.80 GPR84 (0.48) SPHK1CYP2D6LMNAGMNNPOLB
SCHEMBL9801407 0.80 GPR84 (0.48) SPHK1CYP2D6LMNAGMNNPOLB

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-113574041-A Method for producing bisphenol and method for producing polycarbonate resin 三菱化学株式会社 2021-10-29 CN disclosed
WO-2020189201-A1 METHOD FOR PRODUCING BISPHENOL AND METHOD FOR PRODUCING POLYCARBONATE RESIN 三菱ケミカル株式会社 2020-09-24 WO disclosed