SCHEMBL6044969

SCHEMBL6044969

CCOP(=O)(O)Cc1cccc(CP(=O)(O)OCC)n1

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PGK1 P00558 1/20 0.60
PGK2 P07205 1/20 0.60
PPARD Q03181 1/20 0.42
CYP1A2 P05177 1/20 0.42
KDM4E B2RXH2 1/20 0.39
LMNA P02545 1/20 0.39
HPGD P15428 1/20 0.39
POLB P06746 1/20 0.39
NPSR1 Q6W5P4 2/20 0.38
NR1I2 O75469 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 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
SCHEMBL4544102 0.83 PGK1 (0.62) PGK1PGK2CYP1A2LMNAPOLB
SCHEMBL5010543 0.83 PGK1 (0.52) PGK1PGK2PPARDKDM4ELMNA
SCHEMBL17489025 0.83 PGK1 (0.53) PGK1PGK2CYP1A2KDM4ENPSR1
SCHEMBL6044952 0.83 PGK1 (0.53) PGK1PGK2
SCHEMBL6044980 0.78 PGK1 (0.38) PGK1PGK2CYP1A2KDM4ELMNA
SCHEMBL6044987 0.78 PGK1 (0.38) PGK1PGK2CYP1A2KDM4ELMNA
SCHEMBL6044992 0.78 PGK1 (0.38) PGK1PGK2CYP1A2POLBNPSR1
SCHEMBL17488978 0.74 PPARD (0.50) PGK1PGK2PPARDPOLBNPSR1
SCHEMBL915800 0.73 TSHR (0.52) PPARDHPGDPOLBNPSR1NR1I2
SCHEMBL915751 0.73 ACP3 (0.65) CYP1A2KDM4ELMNAHPGDNR1I2

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
US-20060210479-A1 Targeting chelants and chelates DOW GLOBAL TECHNOLOGIES INC. (US) 2006-09-21 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060210479-A1 Targeting chelants and chelates CLTC, CALCOCO2, TFRC PGK1 2785/4885PGK2 2466/4885PPARD 2952/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.