SCHEMBL15840310

SCHEMBL15840310

Cc1nc2cc(F)c(F)cc2c(=O)n1C

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PARG Q86W56 1/20 0.43
HRH3 Q9Y5N1 1/20 0.41
POLB P06746 1/20 0.40
GLA P06280 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
NAMPT P43490 5/20 0.38
ALOX15 P16050 1/20 0.38
HTT P42858 1/20 0.38
HPD P32754 2/20 0.36
KDM4E B2RXH2 3/20 0.36
ALDH1A1 P00352 2/20 0.36
LMNA P02545 1/20 0.36
HPGD P15428 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35

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
SCHEMBL9919072 0.79 POLB (0.55) PARGHRH3POLBGLAL3MBTL1
SCHEMBL15840322 0.79 L3MBTL1 (0.49) PARGHRH3POLBGLAL3MBTL1
SCHEMBL5986479 0.75 CYP3A4 (0.48) PARGHRH3POLBKDM4EALDH1A1
SCHEMBL7602321 0.75 POLB (0.57) PARGHRH3POLBALOX15HTT
SCHEMBL28502890 0.75 TSHR (0.45) POLBL3MBTL1KDM4EALDH1A1HPGD
SCHEMBL15840312 0.74 GLA (0.38) PARGPOLBGLAL3MBTL1KDM4E
SCHEMBL10642137 0.73 ALOX15 (0.59) POLBGLAALOX15HTTKDM4E
SCHEMBL15840316 0.72 POLB (0.35) PARGPOLBGLAL3MBTL1HPD
SCHEMBL8845824 0.72 KMT2A (0.57) POLBRXFP1
SCHEMBL9919073 0.72 CASP3 (0.54) PARGPOLBHTTHPDLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160016915-A1 PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS GILEAD CALISTOGA LLC. 2016-01-21 US disclosed
US-9221795-B2 Phosphatidylinositol 3-kinase inhibitors GILEAD SCIENCES, INC. (US) 2015-12-29 US disclosed
US-9029384-B2 Phosphatidylinositol 3-kinase inhibitors Gilead Calistoga, LLC. (US) 2015-05-12 US disclosed
US-20140371246-A1 PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS GILEAD CALISTOGA LLC 2014-12-18 US disclosed
US-20140179718-A1 PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS GILEAD CALISTOGA LLC (US) 2014-06-26 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 (3 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-20140371246-A1 PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS PIK3CA, PIK3R4, PIK3R5 PARG 4480/4885HRH3 1844/4885POLB 2015/4885
US-20140179718-A1 PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS PIK3R5, PIK3CA, PIK3R4 PARG 4634/4885HRH3 2292/4885POLB 2072/4885
US-20160016915-A1 PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS PIK3R5, PIK3CA, PIK3R4 PARG 4634/4885HRH3 2292/4885POLB 2072/4885

“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.