SCHEMBL11570348

SCHEMBL11570348

COCCOCCOCCC(=O)Cl

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.40
CA2 P00918 1/20 0.39
ALDH1A1 P00352 3/20 0.37
TP53 P04637 1/20 0.37
EPHX2 P34913 2/20 0.33
ABCB11 O95342 1/20 0.31
CYP3A4 P08684 1/20 0.31
ADRA2B P18089 1/20 0.31
OPRD1 P41143 1/20 0.31
SCN5A Q14524 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
SCHEMBL21713199 1.00 TSHR (0.40) TSHRCA2ALDH1A1TP53EPHX2
SCHEMBL13922207 1.00 TSHR (0.40) TSHRCA2ALDH1A1TP53EPHX2
SCHEMBL28603730 1.00 TSHR (0.40) TSHRCA2ALDH1A1TP53EPHX2
SCHEMBL6246216 1.00 TSHR (0.40) TSHRCA2ALDH1A1TP53EPHX2
SCHEMBL11708766 0.87 TSHR (0.43) TSHRALDH1A1TP53
SCHEMBL25841567 0.86 ALDH1A1 (0.44) TSHRCA2ALDH1A1TP53EPHX2
SCHEMBL56801 0.85
SCHEMBL28616847 0.83 ALDH1A1 (0.50) TSHRCA2ALDH1A1TP53EPHX2
SCHEMBL31665165 0.82 TSHR (0.50) TSHRALDH1A1TP53
SCHEMBL13863435 0.81 ADRA2A (0.41) TSHRCA2ALDH1A1TP53EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3801553-B1 PRODRUGS OF FULVESTRANT KASHIV BIOSCIENCES LLC (US) 2026-03-25 EP disclosed
EP-3762386-B1 ADENOSINE RECEPTOR ANTAGONISTS AND USES THEREOF TEON THERAPEUTICS INC (US) 2024-01-24 EP disclosed
US-20230302150-A1 ANTIBODY-TLR AGONIST CONJUGATES, METHODS AND USES THEREOF AMBRX, INC. (US) 2023-09-28 US disclosed
US-20230302150-A1 ANTIBODY-TLR AGONIST CONJUGATES, METHODS AND USES THEREOF AMBRX, INC. (US) 2023-09-28 US disclosed
CN-116457023-A antibody-TLR agonist conjugates, methods and uses thereof AMBRX公司 2023-07-18 CN disclosed
US-20220056033-A1 ADENOSINE RECEPTOR ANTAGONISTS AND USES THEREOF TEON THERAPEUTICS, INC. 2022-02-24 US disclosed
US-11124515-B2 Adenosine receptor antagonists and uses thereof TEON THERAPEUTICS, INC. (US) 2021-09-21 US disclosed
US-20210253626-A1 PRODRUGS OF FULVESTRANT KI PHARMACEUTICALS, LLC 2021-08-19 US disclosed
US-20210163483-A1 ADENOSINE RECEPTOR ANTAGONISTS AND USES THEREOF TEON THERAPEUTICS, INC. 2021-06-03 US disclosed
EP-3801553-A2 PRODRUGS OF FULVESTRANT Kashiv Biosciences, LLC (US) 2021-04-14 EP disclosed
US-20210040097-A1 ADENOSINE RECEPTOR ANTAGONISTS AND USES THEREOF TEON THERAPEUTICS, INC. 2021-02-11 US disclosed
WO-2019173380-A1 ADENOSINE RECEPTOR ANTAGONISTS AND USES THEREOF TEON THERAPEUTICS, INC. (US) 2019-09-12 WO disclosed
US-4152526-A N-acyl derivatives of 3-amino-2,4,6-triiodobenzoic acid CHEMIE LINZ AKTIENGESELLSCHAFT (AT) 1979-05-01 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-20210163483-A1 ADENOSINE RECEPTOR ANTAGONISTS AND USES THEREOF ADORA2A, ADORA2B, ADORA3 TSHR 209/4885CA2 1913/4885ALDH1A1 817/4885
US-20220056033-A1 ADENOSINE RECEPTOR ANTAGONISTS AND USES THEREOF ADORA2A, ADORA2B, ADORA3 TSHR 209/4885CA2 1913/4885ALDH1A1 817/4885
US-20230302150-A1 ANTIBODY-TLR AGONIST CONJUGATES, METHODS AND USES THEREOF TLR3, TLR1, TLR9 TSHR 543/4885CA2 4583/4885ALDH1A1 2172/4885
US-20210253626-A1 PRODRUGS OF FULVESTRANT CYP19A1, PGR, CYP21A2 TSHR 1283/4885CA2 2363/4885ALDH1A1 746/4885
US-11124515-B2 Adenosine receptor antagonists and uses thereof ADORA2B, ADORA2A, ADORA3 TSHR 218/4885CA2 1988/4885ALDH1A1 634/4885
US-20210040097-A1 ADENOSINE RECEPTOR ANTAGONISTS AND USES THEREOF ADORA2A, ADORA2B, ADORA3 TSHR 209/4885CA2 1913/4885ALDH1A1 817/4885

“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.