SCHEMBL22022263

SCHEMBL22022263

BN1C(=O)c2ccc(C(C)(C)C)cc2C1=O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA9 Q16790 6/20 0.53
CA1 P00915 4/20 0.53
CA12 O43570 3/20 0.53
NPC1 O15118 1/20 0.52
ALDH1A1 P00352 1/20 0.52
PLA2G1B P04054 1/20 0.52
NFKB1 P19838 1/20 0.52
CASP3 P42574 1/20 0.52
RAB9A P51151 1/20 0.52
NFKB2 Q00653 1/20 0.52
RELA Q04206 1/20 0.52
SENP8 Q96LD8 1/20 0.52
SENP7 Q9BQF6 1/20 0.52
SENP6 Q9GZR1 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
ATG4B Q9Y4P1 1/20 0.52
CA2 P00918 4/20 0.51
CA4 P22748 1/20 0.46
NR1H3 Q13133 1/20 0.45
TNF P01375 1/20 0.40

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
SCHEMBL26491913 0.86 ALDH1A1 (0.46) CA9CA1CA12NPC1ALDH1A1
SCHEMBL15043753 0.82 NR1H3 (0.58) CA9CA1CA12NPC1ALDH1A1
SCHEMBL12464403 0.82 CA1 (0.58) CA9CA1CA12NPC1ALDH1A1
SCHEMBL19702942 0.81 CA9 (0.53) CA9CA1CA12NPC1ALDH1A1
SCHEMBL14072404 0.78 NPC1 (0.53) CA9CA1CA12NPC1ALDH1A1
SCHEMBL12235644 0.78 CA9 (0.56) CA9CA1CA12NPC1ALDH1A1
SCHEMBL2200817 0.77 CA9 (0.49) CA9CA1CA12NPC1ALDH1A1
SCHEMBL2156201 0.77 CA9 (0.56) CA9CA1CA12NPC1ALDH1A1
SCHEMBL20306714 0.76 CA9 (0.55) CA9CA1CA12ALDH1A1CA2
SCHEMBL15043752 0.75 CA9 (0.58) CA9CA1CA12NPC1ALDH1A1

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-11642342-B2 Combinations of estrogen receptor degraders and cyclin-dependent kinase inhibitors for treating cancer Accutar Biotechnology (US) 2023-05-09 US disclosed
US-11117885-B2 Compounds having estrogen receptor alpha degradation activity and uses thereof ACCUTAR BIOTECHNOLOGY INC. (US) 2021-09-14 US disclosed
US-20210213012-A1 COMBINATIONS OF ESTROGEN RECEPTOR DEGRADERS AND CYCLIN-DEPENDENT KINASE INHIBITORS FOR TREATING CANCER ACCUTAR BIOTECHNOLOGY INC. 2021-07-15 US disclosed
US-20200299264-A1 COMPOUNDS HAVING ESTROGEN RECEPTOR ALPHA DEGRADATION ACTIVITY AND USES THEREOF ACCUTAR BIOTECHNOLOGY INC. (US) 2020-09-24 US disclosed
US-10696659-B2 Compounds having estrogen receptor alpha degradation activity and uses thereof ACCUTAR BIOTECHNOLOGY INC. (US) 2020-06-30 US disclosed
US-20200157078-A1 NOVEL COMPOUNDS HAVING ESTROGEN RECEPTOR ALPHA DEGRADATION ACTIVITY AND USES THEREOF ACCUTAR BIOTECHNOLOGY INC. (US) 2020-05-21 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-11117885-B2 Compounds having estrogen receptor alpha degradation activity and uses thereof ESR2, ESRRG, ESR1 CA9 2444/4885CA1 3283/4885CA12 2758/4885
US-20210213012-A1 COMBINATIONS OF ESTROGEN RECEPTOR DEGRADERS AND CYCLIN-DEPENDENT KINASE INHIBITORS FOR TREATING CANCER CDK3, CDK4, CDK1 CA9 1292/4885CA1 1856/4885CA12 2135/4885
US-20200157078-A1 NOVEL COMPOUNDS HAVING ESTROGEN RECEPTOR ALPHA DEGRADATION ACTIVITY AND USES THEREOF ESR2, ESRRG, ESR1 CA9 2826/4885CA1 3736/4885CA12 2915/4885
US-20200299264-A1 COMPOUNDS HAVING ESTROGEN RECEPTOR ALPHA DEGRADATION ACTIVITY AND USES THEREOF ESR2, ESRRG, ESR1 CA9 2444/4885CA1 3283/4885CA12 2758/4885
US-11642342-B2 Combinations of estrogen receptor degraders and cyclin-dependent kinase inhibitors for treating cancer CDK3, CDK4, CDK1 CA9 1292/4885CA1 1856/4885CA12 2135/4885
US-10696659-B2 Compounds having estrogen receptor alpha degradation activity and uses thereof ESR2, ESRRG, ESR1 CA9 2444/4885CA1 3283/4885CA12 2758/4885

“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.