SCHEMBL19003149

SCHEMBL19003149

CC(C)(O)c1nc2c(N3CCOCC3)nc(Cl)nc2n1CCn1c(C(C)(C)O)nc2c(N3CCOCC3)nc(Cl)nc21

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 3/20 0.57
MTOR P42345 3/20 0.57
PIK3CD O00329 2/20 0.57
CYP3A4 P08684 6/20 0.44
KDM4E B2RXH2 10/20 0.42
ALDH1A1 P00352 10/20 0.42
HPGD P15428 10/20 0.42
HSD17B10 Q99714 10/20 0.42
HDAC1 Q13547 1/20 0.41
TSHR P16473 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.38
ALOX15 P16050 1/20 0.38
CASP1 P29466 1/20 0.36
PDE10A Q9Y233 2/20 0.36
CNR2 P34972 1/20 0.36
HRH3 Q9Y5N1 1/20 0.35
MAPT P10636 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
SCHEMBL1114172 0.94 PIK3CA (0.54) PIK3CAMTORPIK3CDCYP3A4KDM4E
SCHEMBL19003132 0.93 PIK3CA (0.53) PIK3CAMTORPIK3CDCYP3A4KDM4E
SCHEMBL1113999 0.92 PIK3CA (0.52) PIK3CAMTORPIK3CDCYP3A4KDM4E
SCHEMBL1113874 0.88 PIK3CD (0.46) PIK3CAMTORPIK3CDCYP3A4HDAC1
SCHEMBL1113901 0.88 MTOR (0.49) PIK3CAMTORPIK3CDCYP3A4KDM4E
SCHEMBL1114032 0.87 PIK3CA (0.48) PIK3CAMTORPIK3CDCYP3A4KDM4E
SCHEMBL19003133 0.81 PIK3CD (0.41) PIK3CAMTORPIK3CDCYP3A4KDM4E
SCHEMBL25232626 0.80 CYP3A4 (0.52) PIK3CAMTORPIK3CDCYP3A4KDM4E
SCHEMBL9937539 0.79 CYP3A4 (0.41) PIK3CAMTORPIK3CDCYP3A4KDM4E
SCHEMBL30076358 0.79 CYP3A4 (0.41) PIK3CAMTORPIK3CDCYP3A4KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3978500-B1 PROCESS FOR THE PREPARATION OF TRICYCLIC PI3K INHIBITOR COMPOUNDS GENENTECH INC (US) 2023-11-22 EP disclosed
US-20230242550-A1 PROCESS FOR THE PREPARATION OF TRICYCLIC PI3K INHIBITOR COMPOUNDS AND METHODS FOR USING THE SAME FOR THE TREATMENT OF CANCER GENENTECH, INC. 2023-08-03 US disclosed
US-20230242550-A1 PROCESS FOR THE PREPARATION OF TRICYCLIC PI3K INHIBITOR COMPOUNDS AND METHODS FOR USING THE SAME FOR THE TREATMENT OF CANCER GENENTECH, INC. 2023-08-03 US disclosed
US-11643421-B2 Process for the preparation of tricyclic PI3K inhibitor compounds and methods for using the same for the treatment of cancer GENENTECH, INC. (US) 2023-05-09 US disclosed
US-11643421-B2 Process for the preparation of tricyclic PI3K inhibitor compounds and methods for using the same for the treatment of cancer GENENTECH, INC. (US) 2023-05-09 US disclosed
EP-3389662-B1 PROCESS FOR THE PREPARATION OF TRICYCLIC PI3K INHIBITOR COMPOUNDS AND METHODS FOR USING THE SAME FOR THE TREATMENT OF CANCER GENENTECH INC (US) 2021-12-01 EP disclosed
US-20210253599-A1 PROCESS FOR THE PREPARATION OF TRICYCLIC PI3K INHIBITOR COMPOUNDS AND METHODS FOR USING THE SAME FOR THE TREATMENT OF CANCER GENENTECH, INC. 2021-08-19 US disclosed
US-10906918-B2 Process for the preparation of tricyclic PI3K inhibitor compounds and methods for using the same for the treatment of cancer GENENTECH, INC. (US) 2021-02-02 US disclosed
WO-2017106647-A1 PROCESS FOR THE PREPARATION OF TRICYCLIC PI3K INHIBITOR COMPOUNDS AND METHODS FOR USING THE SAME FOR THE TREATMENT OF CANCER GENENTECH, INC. (US) 2017-06-22 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 (4 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-11643421-B2 Process for the preparation of tricyclic PI3K inhibitor compounds and methods for using the same for the treatment of cancer PIK3CA, PIK3CD, PIK3CB PIK3CA 1/4885MTOR 24/4885PIK3CD 2/4885
US-20210253599-A1 PROCESS FOR THE PREPARATION OF TRICYCLIC PI3K INHIBITOR COMPOUNDS AND METHODS FOR USING THE SAME FOR THE TREATMENT OF CANCER PIK3CA, PIK3CD, PIK3CB PIK3CA 1/4885MTOR 24/4885PIK3CD 2/4885
US-20230242550-A1 PROCESS FOR THE PREPARATION OF TRICYCLIC PI3K INHIBITOR COMPOUNDS AND METHODS FOR USING THE SAME FOR THE TREATMENT OF CANCER PIK3CA, PIK3CD, PIK3CB PIK3CA 1/4885MTOR 24/4885PIK3CD 2/4885
US-10906918-B2 Process for the preparation of tricyclic PI3K inhibitor compounds and methods for using the same for the treatment of cancer PIK3CA, PIK3CD, PIK3CB PIK3CA 1/4885MTOR 24/4885PIK3CD 2/4885

“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.