SCHEMBL7218364

SCHEMBL7218364

CC(C)(C)OC(=O)n1ccc2ccc(F)cc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BUB1 O43683 1/20 0.42
ACLY P53396 1/20 0.40
PIK3CD O00329 2/20 0.39
ABL1 P00519 2/20 0.39
EGFR P00533 2/20 0.39
HCK P08631 2/20 0.39
SRC P12931 2/20 0.39
KDR P35968 2/20 0.39
PIK3CA P42336 2/20 0.39
PIK3CB P42338 2/20 0.39
MTOR P42345 2/20 0.39
PIK3CG P48736 2/20 0.39
EPHB4 P54760 2/20 0.39
PRKDC P78527 2/20 0.39
PI4KB Q9UBF8 2/20 0.39
BRD4 O60885 1/20 0.39
FABP4 P15090 1/20 0.39
HTR2C P28335 2/20 0.38
HTR2A P28223 1/20 0.38
HSP90AA1 P07900 1/20 0.38

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
SCHEMBL30711678 1.00 BUB1 (0.42) BUB1ACLYPIK3CDABL1EGFR
SCHEMBL147532 0.89 ACLY (0.46) BUB1ACLYPIK3CDABL1EGFR
SCHEMBL819797 0.88 PIK3CD (0.46) BUB1ACLYPIK3CDABL1EGFR
SCHEMBL18805035 0.88 PIK3CD (0.46) BUB1ACLYPIK3CDABL1EGFR
SCHEMBL30147588 0.84 ACLY (0.43) BUB1ACLYPIK3CDABL1EGFR
SCHEMBL29820909 0.84 HTR6 (0.46) BUB1ACLYPIK3CDABL1EGFR
SCHEMBL10193516 0.84 BUB1 (0.40) BUB1ACLYPIK3CDABL1EGFR
SCHEMBL1373109 0.84 HTR6 (0.46) BUB1ACLYPIK3CDABL1EGFR
SCHEMBL31424162 0.84 ACLY (0.43) BUB1ACLYPIK3CDABL1EGFR
SCHEMBL23330949 0.83 MAP2K4 (0.43) BUB1ACLYPIK3CDABL1EGFR

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-3434668-B1 INDOLO-SUBSTITUTED-PIPERIDINE COMPOUNDS AS ESTROGEN RECEPTOR DEGRADING AGENT LUOXIN PHARMACEUTICAL SHANGHAI CO LTD (CN) 2020-08-26 EP disclosed
US-10544095-B2 3-indol substituted derivatives, pharmaceutical compositions and methods for use PFIZER INC. (US) 2020-01-28 US disclosed
US-20190106414-A1 SUBSTITUTED-INDOLE-COMPOUNDS AS ESTROGEN RECEPTOR DOWN-REGULATORS Luoxin Healthcare Science and Technology Development (Beijing) Ltd. (CN) 2019-04-11 US disclosed
EP-3434668-A1 INDOLO-SUBSTITUTED-PIPERIDINE COMPOUNDS AS ESTROGEN RECEPTOR DEGRADING AGENT Luoxin Biotechnology (Shanghai) Co., Ltd. (CN) 2019-01-30 EP disclosed
US-20180222862-A1 NOVEL 3-INDOL SUBSTITUTED DERIVATIVES, PHARMACEUTICAL COMPOSITIONS AND METHODS FOR USE ITEOS THERAPEUTICS (BE) 2018-08-09 US disclosed
US-9873690-B2 3-indol substituted derivatives, pharmaceutical compositions and methods for use PFIZER INC (US) 2018-01-23 US disclosed
US-20160272628-A1 NOVEL 3-INDOL SUBSTITUTED DERIVATIVES, PHARMACEUTICAL COMPOSITIONS AND METHODS FOR USE PFIZER INC. 2016-09-22 US disclosed
EP-1358162-A1 DIHYDROINDOLE AND TETRAHYDROQUINOLINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2003-11-05 EP disclosed
WO-2002050041-A1 DIHYDROINDOLE AND TETRAHYDROQUINOLINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2002-06-27 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-10544095-B2 3-indol substituted derivatives, pharmaceutical compositions and methods for use TDO2, IDO1, IDO2 BUB1 3199/4885ACLY 1017/4885PIK3CD 1425/4885
US-20180222862-A1 NOVEL 3-INDOL SUBSTITUTED DERIVATIVES, PHARMACEUTICAL COMPOSITIONS AND METHODS FOR USE TDO2, IDO1, IDO2 BUB1 3074/4885ACLY 1230/4885PIK3CD 1567/4885
US-20190106414-A1 SUBSTITUTED-INDOLE-COMPOUNDS AS ESTROGEN RECEPTOR DOWN-REGULATORS ESR2, ESR1, GPER1 BUB1 1535/4885ACLY 3844/4885PIK3CD 1332/4885
US-20160272628-A1 NOVEL 3-INDOL SUBSTITUTED DERIVATIVES, PHARMACEUTICAL COMPOSITIONS AND METHODS FOR USE TDO2, IDO1, IDO2 BUB1 3074/4885ACLY 1230/4885PIK3CD 1567/4885

“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.