SCHEMBL20542005

SCHEMBL20542005

O=C(NC12CC(C(=O)O)(C1)C2)c1cccc2ccn(Cc3ccc(C(F)(F)F)cc3)c12

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 7/20 0.67
PTGDR Q13258 7/20 0.67
TBXA2R P21731 1/20 0.67
PTGER1 P34995 1/20 0.67
PTGFR P43088 1/20 0.67
PTGER3 P43115 1/20 0.67
PTGER2 P43116 1/20 0.67
KDM4E B2RXH2 2/20 0.44
ALDH1A1 P00352 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.42
DRD4 P21917 1/20 0.41
KCNQ3 O43525 2/20 0.40
KCNQ2 O43526 2/20 0.40
KCNQ4 P56696 2/20 0.40
KCNQ5 Q9NR82 2/20 0.40
FABP4 P15090 2/20 0.39
HIF1A Q16665 1/20 0.38
EPAS1 Q99814 1/20 0.38
HDAC11 Q96DB2 1/20 0.37
ATM Q13315 1/20 0.37

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
SCHEMBL20541688 0.90 PTGER4 (0.64) PTGER4PTGDRTBXA2RPTGER1PTGFR
SCHEMBL30498013 0.90 PTGER4 (0.64) PTGER4PTGDRTBXA2RPTGER1PTGFR
SCHEMBL20542163 0.90 PTGER4 (0.62) PTGER4PTGDRTBXA2RPTGER1PTGFR
SCHEMBL20542052 0.89 PTGER4 (0.64) PTGER4PTGDRTBXA2RPTGER1PTGFR
SCHEMBL22276038 0.89 PTGER4 (0.66) PTGER4PTGDRTBXA2RPTGER1PTGFR
SCHEMBL26254084 0.89 PTGER4 (0.63) PTGER4PTGDRTBXA2RPTGER1PTGFR
SCHEMBL20541857 0.89 PTGER4 (0.63) PTGER4PTGDRTBXA2RPTGER1PTGFR
SCHEMBL30498014 0.89 PTGER4 (0.63) PTGER4PTGDRTBXA2RPTGER1PTGFR
SCHEMBL22392940 0.88 PTGER4 (0.62) PTGER4PTGDRTBXA2RPTGER1PTGFR
SCHEMBL26254025 0.88 PTGER4 (0.62) PTGER4PTGDRTBXA2RPTGER1PTGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11738009-B2 Bicyclic compounds and their use in the treatment of cancer TEMPEST THERAPEUTICS, INC. (US) 2023-08-29 US disclosed
US-11638704-B2 Bicyclic compounds and their use in the treatment of cancer TEMPEST THERAPEUTICS, INC. (US) 2023-05-02 US disclosed
US-20210387985-A1 BICYCLIC COMPOUNDS AND THEIR USE IN THE TREATMENT OF CANCER TEMPEST THERAPEUTICS, INC. 2021-12-16 US disclosed
US-11066405-B2 Bicyclic compounds and their use in the treatment of cancer TEMPEST THERAPEUTICS, INC. (US) 2021-07-20 US disclosed
US-20210008046-A1 BICYCLIC COMPOUNDS AND THEIR USE IN THE TREATMENT OF CANCER TEMPEST THERAPEUTICS, INC. 2021-01-14 US disclosed
US-20200283438-A1 BICYCLIC COMPOUNDS AND THEIR USE IN THE TREATMENT OF CANCER TEMPEST THERAPEUTICS, INC. 2020-09-10 US disclosed
EP-3612517-A1 BICYCLIC COMPOUNDS AND THEIR USE IN THE TREATMENT OF CANCER Tempest Therapeutics, Inc. (US) 2020-02-26 EP disclosed
WO-2018195123-A1 BICYCLIC COMPOUNDS AND THEIR USE IN THE TREATMENT OF CANCER TEMPEST THERAPEUTICS, INC. (US) 2018-10-25 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 (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-11066405-B2 Bicyclic compounds and their use in the treatment of cancer PTGER4, PTGER1, PTGER3 PTGER4 1/4885PTGDR 5/4885TBXA2R 73/4885
US-20210008046-A1 BICYCLIC COMPOUNDS AND THEIR USE IN THE TREATMENT OF CANCER PTGER4, PTGER1, PTGER3 PTGER4 1/4885PTGDR 5/4885TBXA2R 73/4885
US-11738009-B2 Bicyclic compounds and their use in the treatment of cancer PTGER4, PTGER1, PTGER3 PTGER4 1/4885PTGDR 5/4885TBXA2R 73/4885
US-20210387985-A1 BICYCLIC COMPOUNDS AND THEIR USE IN THE TREATMENT OF CANCER PTGER4, PTGER1, PTGER3 PTGER4 1/4885PTGDR 5/4885TBXA2R 60/4885
US-11638704-B2 Bicyclic compounds and their use in the treatment of cancer PTGER4, PTGER1, PTGER3 PTGER4 1/4885PTGDR 5/4885TBXA2R 60/4885
US-20200283438-A1 BICYCLIC COMPOUNDS AND THEIR USE IN THE TREATMENT OF CANCER PTGER4, PTGER1, PTGER3 PTGER4 1/4885PTGDR 5/4885TBXA2R 73/4885

“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.