SCHEMBL9937364

SCHEMBL9937364

OCCCn1c(I)nc2c(N3CCOCC3)nc(Cl)nc21

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 7/20 0.41
KDM4E B2RXH2 10/20 0.40
ALDH1A1 P00352 10/20 0.40
HPGD P15428 10/20 0.40
HSD17B10 Q99714 10/20 0.40
SLC29A1 Q99808 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
HDAC1 Q13547 1/20 0.39
PIK3CA P42336 2/20 0.38
MTOR P42345 2/20 0.38
PIK3CD O00329 1/20 0.38
ALOX15 P16050 1/20 0.37
MAPT P10636 1/20 0.37
TSHR P16473 3/20 0.35
HRH3 Q9Y5N1 2/20 0.35
P2RX3 P56373 1/20 0.35
NT5E P21589 1/20 0.35
CASP1 P29466 1/20 0.34

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
SCHEMBL9936490 0.84 CYP3A4 (0.40) CYP3A4KDM4EALDH1A1HPGDHSD17B10
SCHEMBL30076358 0.83 CYP3A4 (0.41) CYP3A4KDM4EALDH1A1HPGDHSD17B10
SCHEMBL9937539 0.83 CYP3A4 (0.41) CYP3A4KDM4EALDH1A1HPGDHSD17B10
SCHEMBL9937775 0.80 HSD17B10 (0.41) CYP3A4KDM4EALDH1A1HPGDHSD17B10
SCHEMBL9938505 0.79 HRH3 (0.38) CYP3A4KDM4EALDH1A1HPGDHSD17B10
SCHEMBL2674207 0.78 HDAC1 (0.45) CYP3A4KDM4EALDH1A1HPGDHSD17B10
SCHEMBL25233723 0.78 CYP3A4 (0.60) CYP3A4KDM4EALDH1A1HPGDHSD17B10
SCHEMBL2396728 0.73 CYP3A4 (0.45) CYP3A4KDM4EALDH1A1HPGDHSD17B10
SCHEMBL1113999 0.73 PIK3CA (0.52) CYP3A4KDM4EALDH1A1HPGDHSD17B10
SCHEMBL25281454 0.73 CNR2 (0.42) SMN1; SMN2HDAC1HRH3NT5E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250388599-A1 TRICYCLIC PI3K INHIBITOR COMPOUNDS AND METHODS OF USE GENENTECH INC (US) 2025-12-25 US disclosed
US-20220348593-A1 TRICYCLIC PI3K INHIBITOR COMPOUNDS AND METHODS OF USE GENENTECH, INC. 2022-11-03 US disclosed
US-20190330235-A1 TRICYCLIC P13K INHIBITOR COMPOUNDS AND METHODS OF USE GENENTECH INC (US) 2019-10-31 US disclosed
US-20170233407-A1 TRICYCLIC P13K INHIBITOR COMPOUNDS AND METHODS OF USE GENENTECH INC (US) 2017-08-17 US disclosed
US-9546182-B2 Tricyclic PI3K inhibitor compounds and methods of use GENENTECH, INC. 2017-01-17 US disclosed
EP-3053925-A1 TRICYCLIC PI3K INHIBITOR COMPOUNDS AND METHODS OF USE F. Hoffmann-La Roche AG (CH) 2016-08-10 EP disclosed
EP-2813506-B1 Tricyclic PI3K inhibitor compounds and methods of use HOFFMANN LA ROCHE (CH) 2016-05-25 EP disclosed
US-20150079081-A1 TRICYCLIC P13K INHIBITOR COMPOUNDS AND METHODS OF USE GENENTECH, INC. (US) 2015-03-19 US disclosed
EP-2813506-A1 Tricyclic PI3K inhibitor compounds and methods of use F. Hoffmann-La Roche AG (CH) 2014-12-17 EP disclosed
EP-2651951-B1 TRICYCLIC PI3K INHIBITOR COMPOUNDS AND METHODS OF USE HOFFMANN LA ROCHE (CH) 2014-11-19 EP disclosed
US-8883799-B2 Tricyclic PI3K inhibitor compounds and methods of use GENENTECH, INC. (US) 2014-11-11 US disclosed
EP-2651951-A1 TRICYCLIC PI3K INHIBITOR COMPOUNDS AND METHODS OF USE F.HOFFMANN-LA ROCHE AG (CH) 2013-10-23 EP disclosed
US-20120171199-A1 TRICYCLIC PI3K INHIBITOR COMPOUNDS AND METHODS OF USE NOVOGEN LIMITED (AU) 2012-07-05 US disclosed
WO-2012082997-A1 TRICYCLIC PI3K INHIBITOR COMPOUNDS AND METHODS OF USE F. HOFFMANN-LA-ROCHE AG (CH) 2012-06-21 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 (6 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-20190330235-A1 TRICYCLIC P13K INHIBITOR COMPOUNDS AND METHODS OF USE PI4KB, PI4KA, PIK3CA CYP3A4 1190/4885KDM4E 2156/4885ALDH1A1 4549/4885
US-20120171199-A1 TRICYCLIC PI3K INHIBITOR COMPOUNDS AND METHODS OF USE PIK3CA, PIK3CD, MTOR CYP3A4 1099/4885KDM4E 3330/4885ALDH1A1 4455/4885
US-20170233407-A1 TRICYCLIC P13K INHIBITOR COMPOUNDS AND METHODS OF USE PI4KB, PI4KA, PIK3CA CYP3A4 1190/4885KDM4E 2156/4885ALDH1A1 4549/4885
US-20220348593-A1 TRICYCLIC PI3K INHIBITOR COMPOUNDS AND METHODS OF USE PIK3CA, PIK3CD, MTOR CYP3A4 1099/4885KDM4E 3330/4885ALDH1A1 4455/4885
US-20150079081-A1 TRICYCLIC P13K INHIBITOR COMPOUNDS AND METHODS OF USE PI4KB, PI4KA, PIK3CA CYP3A4 1190/4885KDM4E 2156/4885ALDH1A1 4549/4885
US-20250388599-A1 TRICYCLIC PI3K INHIBITOR COMPOUNDS AND METHODS OF USE PIK3C2B, PIK3C2A, PIK3R1 CYP3A4 2620/4885KDM4E 3811/4885ALDH1A1 4070/4885

“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.