SCHEMBL10136705

SCHEMBL10136705

C=Cc1cc(P(=O)(OCC)c2ccc(F)cc2)ccc1OC(C)C

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.37
KMT2A Q03164 3/20 0.33
LMNA P02545 2/20 0.32
GAA P10253 2/20 0.32
MEN1 O00255 2/20 0.32
UTRN P46939 1/20 0.32
KDM4E B2RXH2 2/20 0.32
CCNT1 O60563 1/20 0.31
CDK9 P50750 1/20 0.31
P2RX3 P56373 1/20 0.31
NPSR1 Q6W5P4 2/20 0.31
MAPT P10636 1/20 0.31
HIF1A Q16665 1/20 0.31
ATM Q13315 1/20 0.30

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
SCHEMBL15216135 1.00 ALDH1A1 (0.37) ALDH1A1KMT2ALMNAGAAMEN1
SCHEMBL313267 0.89 KMT2A (0.40) ALDH1A1KMT2AGAAMEN1CCNT1
SCHEMBL15216136 0.89 KMT2A (0.40) ALDH1A1KMT2AGAAMEN1CCNT1
SCHEMBL313534 0.88 RXFP1 (0.34) KMT2ALMNAGAAMEN1P2RX3
SCHEMBL15216134 0.88 RXFP1 (0.34) KMT2ALMNAGAAMEN1P2RX3
SCHEMBL608898 0.87 ADAM17 (0.36) ALDH1A1KMT2AGAAMEN1CCNT1
SCHEMBL15216138 0.84 NPSR1 (0.32) KMT2ALMNAGAAMEN1NPSR1
SCHEMBL313630 0.84 NPSR1 (0.32) KMT2ALMNAGAAMEN1NPSR1
SCHEMBL608882 0.83 HTR2A (0.34) ALDH1A1KMT2AMEN1CCNT1CDK9
SCHEMBL14806631 0.81 ADAM17 (0.30) ALDH1A1MAPT

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
US-20130030209-A1 PHOSPHINATE RUTHENIUM COMPLEXES IDENIX PHARMACEUTICALS, INC. (US) 2013-01-31 US disclosed
US-8309737-B2 Phosphinate ruthenium complexes IDENIX PHARMACEUTICALS, INC. (US) 2012-11-13 US disclosed
US-20120041191-A1 PHOSPHINATE RUTHENIUM COMPLEXES IDENIX PHARMACEUTICALS, INC. (US) 2012-02-16 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 (2 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-20120041191-A1 PHOSPHINATE RUTHENIUM COMPLEXES RPIA, NDUFS7, PHOSPHO1 ALDH1A1 3900/4885KMT2A 4091/4885LMNA 4697/4885
US-20130030209-A1 PHOSPHINATE RUTHENIUM COMPLEXES RPIA, NDUFS7, POP1 ALDH1A1 3489/4885KMT2A 4222/4885LMNA 4670/4885

“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.