SCHEMBL18696397

SCHEMBL18696397

C=Cc1c(C2CC2)nc2ccccc2c1-c1ccc(F)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 2/20 0.65
PRKAA2 P54646 1/20 0.65
NR1I2 O75469 1/20 0.60
NR4A2 P43354 1/20 0.60
PDE4D Q08499 1/20 0.60
HMGCR P04035 2/20 0.57
ADORA2A P29274 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.38
TNKS O95271 1/20 0.38
TNKS2 Q9H2K2 1/20 0.38
PARP2 Q9UGN5 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
BCHE P06276 1/20 0.38
ACHE P22303 1/20 0.38
FABP4 P15090 1/20 0.37
FABP5 Q01469 1/20 0.37
MERTK Q12866 1/20 0.37
SCN9A Q15858 1/20 0.36
KDM4E B2RXH2 1/20 0.36
CYP1A2 P05177 1/20 0.36

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
SCHEMBL8846271 0.88 RXRA (0.64) RXRAPRKAA2NR1I2NR4A2PDE4D
SCHEMBL244423 0.88 RXRA (0.67) RXRAPRKAA2NR1I2NR4A2PDE4D
SCHEMBL29419163 0.88 RXRA (0.67) RXRAPRKAA2NR1I2NR4A2PDE4D
SCHEMBL28287583 0.88 RXRA (0.64) RXRAPRKAA2NR1I2NR4A2PDE4D
SCHEMBL526489 0.86 RXRA (0.68) RXRAPRKAA2NR1I2NR4A2PDE4D
SCHEMBL10129907 0.86 RXRA (0.68) RXRAPRKAA2NR1I2NR4A2PDE4D
SCHEMBL526488 0.86 RXRA (0.68) RXRAPRKAA2NR1I2NR4A2PDE4D
SCHEMBL18947956 0.86 RXRA (0.64) RXRAPRKAA2NR1I2NR4A2PDE4D
SCHEMBL29466456 0.84 RXRA (0.75) RXRAPRKAA2NR1I2NR4A2PDE4D
SCHEMBL1844436 0.84 RXRA (0.75) RXRAPRKAA2NR1I2NR4A2PDE4D

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
US-20210008217-A1 Tumor Homing Statin Derivatives Da Zen Theranostics, Inc. (US) 2021-01-14 US disclosed
EP-3333155-A1 METHOD FOR PRODUCING PITAVASTATIN CALCIUM API Corporation (JP) 2018-06-13 EP disclosed
EP-3299359-A1 CRYSTALLINE AND AMORPHOUS FORMS OF PITAVASTATIN HEMICALCIUM SALT Nissan Chemical Industries, Ltd. (JP) 2018-03-28 EP disclosed
EP-2788341-B1 PROCESS FOR THE PREPARATION OF A THIOPRECURSOR FOR STATINS DSM SINOCHEM PHARM NL BV (NL) 2017-04-05 EP 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-20210008217-A1 Tumor Homing Statin Derivatives HMGCR, DHCR7, DHODH RXRA 2237/4885PRKAA2 4128/4885NR1I2 1725/4885

“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.