SCHEMBL27675562

SCHEMBL27675562

O=P(O)(OCC(O)CO)Oc1ccccc1.[NaH]

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.50
SRC P12931 1/20 0.46
ANPEP P15144 2/20 0.43
LAP3 P28838 2/20 0.43
POLB P06746 1/20 0.40
TSHR P16473 2/20 0.39
MAPK1 P28482 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
CYP1A2 P05177 2/20 0.37
KDM4E B2RXH2 1/20 0.37
AGTR1 P30556 1/20 0.37
LMNA P02545 1/20 0.37

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
SCHEMBL428419 0.98 ALDH1A1 (0.51) ALDH1A1SRCANPEPLAP3POLB
SCHEMBL28831946 0.84 SRC (0.44) ALDH1A1SRCANPEPLAP3TSHR
SCHEMBL28831943 0.84 SRC (0.44) ALDH1A1SRCANPEPLAP3TSHR
SCHEMBL11714352 0.79 SRC (0.50) ALDH1A1SRCANPEPLAP3POLB
SCHEMBL4630199 0.79 ANPEP (0.54) ALDH1A1SRCANPEPLAP3POLB
SCHEMBL11787681 0.79 SRC (0.50) ALDH1A1SRCANPEPLAP3POLB
SCHEMBL1347091 0.78 SRC (0.53) ALDH1A1SRCANPEPLAP3POLB
SCHEMBL17513028 0.77 SMN1; SMN2 (0.44) ALDH1A1KDM4ELMNA
SCHEMBL11234177 0.76 ANPEP (0.55) ALDH1A1SRCANPEPLAP3POLB
SCHEMBL9294505 0.76 CFTR (0.41) ALDH1A1POLBTSHRCYP2C19CYP1A2

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
CN-1931360-A Double timephase neo-insulin zinc injection (30%) and its prepn process JIANGSU WANGBANG BIOCHEMICAL M (CN) 2007-03-21 CN disclosed