SCHEMBL2800319

SCHEMBL2800319

CC(C)(C)OC(=O)N1CCC(Oc2ncnc3ccccc23)CC1

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 5/20 0.59
PIK3CA P42336 2/20 0.59
PIK3CB P42338 2/20 0.59
PIK3CG P48736 2/20 0.59
GPR119 Q8TDV5 11/20 0.56

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
SCHEMBL633987 0.84 PIK3CD (0.67) PIK3CDPIK3CAPIK3CBPIK3CGGPR119
SCHEMBL23699115 0.84 PIK3CD (0.48) PIK3CDPIK3CAPIK3CBPIK3CGGPR119
SCHEMBL5462197 0.82 GPR119 (0.51) PIK3CDGPR119
SCHEMBL23707520 0.82 IDO1 (0.52) PIK3CDPIK3CAPIK3CBPIK3CGGPR119
SCHEMBL29862872 0.82 GPR119 (0.51) PIK3CDGPR119
SCHEMBL19297216 0.82 GPR119 (0.50) PIK3CDPIK3CAPIK3CBPIK3CGGPR119
SCHEMBL4470775 0.81 GPR119 (0.51) PIK3CDPIK3CAPIK3CBPIK3CGGPR119
SCHEMBL28775154 0.81 GPR119 (0.59) PIK3CDPIK3CAPIK3CBPIK3CGGPR119
SCHEMBL29808551 0.81 GPR119 (0.59) PIK3CDPIK3CAPIK3CBPIK3CGGPR119
SCHEMBL20183390 0.81 JAK3 (0.57) PIK3CDPIK3CAPIK3CBPIK3CGGPR119

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
US-20210379052-A1 QUINOLINE DERIVATIVE HAVING INDOLEAMINE-2,3-DIOXYGENASE INHIBITORY ACTIVITY SHENZHEN CHIPSCREEN BIOSCIENCES CO., LTD. (CN) 2021-12-09 US disclosed
EP-3858813-A1 QUINOLONE DERIVATIVE HAVING INDOLEAMINE-2,3-DIOXYGENASE INHIBITED ACTIVITY Shenzhen Chipscreen Biosciences Co., Ltd. (CN) 2021-08-04 EP disclosed
US-20160152576-A9 AKT PROTEIN KINASE INHIBITORS ARRAY BIOPHARMA, INC. (US) 2016-06-02 US disclosed
US-20140148436-A1 AKT PROTEIN KINASE INHIBITORS ARRAY BIOPHARMA, INC. (US) 2014-05-29 US disclosed
US-8680114-B2 AKT protein kinase inhibitors ARRAY BIOPHARMA, INC. (US) 2014-03-25 US disclosed
US-20100168123-A1 AKT PROTEIN KINASE INHIBITORS ARRAY BIOPHARMA INC. 2010-07-01 US disclosed
EP-1684694-A2 AKT PROTEIN KINASE INHIBITORS Array Biopharma, Inc. (US) 2006-08-02 EP disclosed
US-20050130954-A1 Serine/threonine protein kinase inhibitors; hyperproliferative disorder or inflammatory conditions; e.g. 4-(4-(2-amino-3-(p-chlorophenyl)-propionyl)-piperazin-1-yl)-quinazoline ARRAY BIOPHARMA INC. 2005-06-16 US disclosed
WO-2005051304-A2 AKT PROTEIN KINASE INHIBITORS ARRAY BIOPHARMA INC. (US) 2005-06-09 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 (5 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-20100168123-A1 AKT PROTEIN KINASE INHIBITORS AKT1, AKT2, AKT3 PIK3CD 38/4885PIK3CA 13/4885PIK3CB 53/4885
US-20210379052-A1 QUINOLINE DERIVATIVE HAVING INDOLEAMINE-2,3-DIOXYGENASE INHIBITORY ACTIVITY IDO1, IDO2, INMT PIK3CD 2892/4885PIK3CA 3794/4885PIK3CB 3030/4885
US-20140148436-A1 AKT PROTEIN KINASE INHIBITORS AKT1, AKT2, AKT3 PIK3CD 38/4885PIK3CA 13/4885PIK3CB 53/4885
US-20160152576-A9 AKT PROTEIN KINASE INHIBITORS AKT1, AKT2, AKT3 PIK3CD 38/4885PIK3CA 13/4885PIK3CB 53/4885
US-20050130954-A1 Serine/threonine protein kinase inhibitors; hyperproliferative disorder or inflammatory conditions; e.g. 4-(4-(2-amino-3-(p-chlorophenyl)-propionyl)-piperazin-1-yl)-quinazoline MTOR, CDK2, CLK2 PIK3CD 216/4885PIK3CA 130/4885PIK3CB 244/4885

“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.