SCHEMBL20182530

SCHEMBL20182530

CC(C)(C)c1cc(CC(C)(C)c2cccs2)co1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ACLY P53396 1/20 0.33
CNR1 P21554 3/20 0.32
CNR2 P34972 3/20 0.32
ESR1 P03372 1/20 0.31
PRMT6 Q96LA8 1/20 0.31

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
SCHEMBL22096311 0.73 ACLY (0.35) ACLYCNR1CNR2ESR1
SCHEMBL20327695 0.73 ACLY (0.32) ACLY
SCHEMBL12756348 0.71 ESR1 (0.35) ESR1
SCHEMBL26898334 0.71
SCHEMBL23219398 0.70 ACLY (0.36) ACLYCNR1CNR2ESR1
SCHEMBL22676995 0.70 ESR1 (0.32) ESR1
SCHEMBL18735598 0.70 ACLY (0.34) ACLYCNR1CNR2ESR1PRMT6
SCHEMBL22147282 0.68 PON1 (0.40) ACLYCNR1CNR2ESR1
SCHEMBL26746359 0.68 CYP1A1 (0.35) ACLYCNR1CNR2ESR1
SCHEMBL19750753 0.68 CCR9 (0.33) ACLY

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230157999-A1 PYRANO[4,3-B]INDOLE DERIVATIVES AS ALPHA-1-ANTITRYPSIN MODULATORS FOR TREATING ALPHA-1-ANTITRYPSIN DEFICIENCY (AATD) VERTEX PHARMACEUTICALS (SAN DIEGO) LLC 2023-05-25 US disclosed
US-10786480-B2 Combination therapy of a HIF-2-α inhibitor and an immunotherapeutic agent and uses thereof PELOTON THERAPEUTICS, INC. (US) 2020-09-29 US disclosed
US-20190282535-A1 COMBINATION THERAPY OF A HIF-2-ALPHA INHIBITOR AND AN IMMUNOTHERAPEUTIC AGENT AND USES THEREOF PELOTON THERAPEUTICS, INC. 2019-09-19 US disclosed
US-10335388-B2 Combination therapy of a HIF-2-alpha inhibitor and an immunotherapeutic agent and uses thereof PELOTON THERAPEUTICS, INC. (US) 2019-07-02 US disclosed
US-20190048421-A1 BIOMARKERS OF RESPONSE TO HIF-2-ALPHA INHIBITION IN CANCER AND METHODS FOR THE USE THEREOF THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2019-02-14 US disclosed
US-20180140569-A1 COMBINATION THERAPY OF A HIF-2-ALPHA INHIBITOR AND AN IMMUNOTHERAPEUTIC AGENT AND USES THEREOF PELOTON THERAPEUTICS, INC. (US) 2018-05-24 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 (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-20190282535-A1 COMBINATION THERAPY OF A HIF-2-ALPHA INHIBITOR AND AN IMMUNOTHERAPEUTIC AGENT AND USES THEREOF HIF1AN, HIF1A, EGLN2 ACLY 524/4885CNR1 2910/4885CNR2 1211/4885
US-10786480-B2 Combination therapy of a HIF-2-α inhibitor and an immunotherapeutic agent and uses thereof HIF1AN, HIF1A, EGLN2 ACLY 564/4885CNR1 2933/4885CNR2 1312/4885
US-20230157999-A1 PYRANO[4,3-B]INDOLE DERIVATIVES AS ALPHA-1-ANTITRYPSIN MODULATORS FOR TREATING ALPHA-1-ANTITRYPSIN DEFICIENCY (AATD) SERPINA2, SERPINB1, SERPINE1 ACLY 1217/4885CNR1 2936/4885CNR2 4440/4885
US-20190048421-A1 BIOMARKERS OF RESPONSE TO HIF-2-ALPHA INHIBITION IN CANCER AND METHODS FOR THE USE THEREOF HIF1AN, HIF1A, EGLN2 ACLY 1011/4885CNR1 3806/4885CNR2 2236/4885
US-20180140569-A1 COMBINATION THERAPY OF A HIF-2-ALPHA INHIBITOR AND AN IMMUNOTHERAPEUTIC AGENT AND USES THEREOF HIF1AN, HIF1A, EGLN2 ACLY 440/4885CNR1 2770/4885CNR2 1014/4885
US-10335388-B2 Combination therapy of a HIF-2-alpha inhibitor and an immunotherapeutic agent and uses thereof HIF1AN, HIF1A, EGLN2 ACLY 440/4885CNR1 2770/4885CNR2 1014/4885

“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.