SCHEMBL4544102

SCHEMBL4544102

COP(=O)(O)Cc1cccc(CP(=O)(O)OC)n1

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PGK1 P00558 1/20 0.62
PGK2 P07205 1/20 0.62
NPSR1 Q6W5P4 1/20 0.39
CYP1A2 P05177 1/20 0.35
ACP3 P15309 1/20 0.34
LAP3 P28838 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
POLB P06746 2/20 0.33
KCNH2 Q12809 2/20 0.33
LMNA P02545 2/20 0.33
HRH4 Q9H3N8 1/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL6044969 0.83 PGK1 (0.60) PGK1PGK2NPSR1CYP1A2POLB
SCHEMBL4544109 0.80 PGK1 (0.41) PGK1PGK2CYP1A2
SCHEMBL4544108 0.79 PGK1 (0.40) PGK1PGK2
SCHEMBL4544106 0.79 PGK1 (0.40) PGK1PGK2
SCHEMBL17489025 0.78 PGK1 (0.53) PGK1PGK2NPSR1CYP1A2TSHR
SCHEMBL6044952 0.78 PGK1 (0.53) PGK1PGK2KCNH2
SCHEMBL16277737 0.73 PGK1 (0.67) PGK1PGK2ACP3
SCHEMBL18363067 0.73 ENPP2 (0.41) PGK1PGK2LAP3POLBLMNA
SCHEMBL232550 0.72 LAP3 (0.51) LAP3POLBLMNATSHR
SCHEMBL17537480 0.70 PGK1 (0.58) PGK1PGK2NPSR1ACP3POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1778699-A4 TARGETING CHELANTS AND CHELATES DOW GLOBAL TECHNOLOGIES INC (US) 2009-02-25 EP disclosed
EP-1778699-A2 TARGETING CHELANTS AND CHELATES Dow Gloval Technologies Inc. (US) 2007-05-02 EP disclosed
US-20060210479-A1 Targeting chelants and chelates DOW GLOBAL TECHNOLOGIES INC. (US) 2006-09-21 US disclosed
WO-2006020779-A2 TARGETING CHELANTS AND CHELATES DOW GLOBAL TECHNOLOGIES INC. (US) 2006-02-23 WO 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 2466/4885NPSR1 4267/4885

“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.