SCHEMBL10074065

SCHEMBL10074065

COC(=O)Cc1c(C2CC2)nc2ccccc2c1-c1ccc(F)cc1

nearest known ligand 0.68

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PRKAA2 P54646 1/20 0.68
RXRA P19793 2/20 0.54
NR1I2 O75469 1/20 0.51
NR4A2 P43354 1/20 0.51
PDE4D Q08499 1/20 0.51
HMGCR P04035 1/20 0.49
TSHR P16473 1/20 0.45
MAPK1 P28482 1/20 0.45
SMN1; SMN2 Q16637 3/20 0.44
SCN9A Q15858 1/20 0.41
CASP3 P42574 2/20 0.40
LMNA P02545 1/20 0.40
ACACA Q13085 1/20 0.39
ALDH1A1 P00352 1/20 0.39
FABP4 P15090 1/20 0.39
FABP5 Q01469 1/20 0.39

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
SCHEMBL27936537 0.88 PRKAA2 (0.76) PRKAA2RXRANR1I2NR4A2PDE4D
SCHEMBL14163464 0.83 PRKAA2 (0.72) PRKAA2RXRANR1I2NR4A2PDE4D
SCHEMBL356302 0.82 PRKAA2 (0.61) PRKAA2RXRANR1I2NR4A2PDE4D
SCHEMBL30060873 0.81 PRKAA2 (1.00) PRKAA2RXRANR1I2NR4A2PDE4D
SCHEMBL14749820 0.81 PRKAA2 (0.77) PRKAA2RXRANR1I2NR4A2PDE4D
SCHEMBL31546 0.81 PRKAA2 (1.00) PRKAA2RXRANR1I2NR4A2PDE4D
SCHEMBL27947390 0.81 PRKAA2 (0.72) PRKAA2RXRANR1I2NR4A2PDE4D
SCHEMBL27947387 0.80 PRKAA2 (0.60) PRKAA2RXRANR1I2NR4A2PDE4D
SCHEMBL24454 0.79 PRKAA2 (0.77) PRKAA2RXRANR1I2NR4A2PDE4D
SCHEMBL3709827 0.79 PRKAA2 (0.77) PRKAA2RXRANR1I2NR4A2PDE4D

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-20120016129-A1 Process for Preparing Pitavastatin, Intermediates and Pharmaceuctically Acceptable Salts Thereof MSN LABORATORIES LIMITED (IN) 2012-01-19 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-20120016129-A1 Process for Preparing Pitavastatin, Intermediates and Pharmaceuctically Acceptable Salts Thereof PCSK9, HMGCR, HDLBP PRKAA2 679/4885RXRA 695/4885NR1I2 3388/4885

“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.