SCHEMBL21932264

SCHEMBL21932264

CN1Cc2ccc(C(=O)O)cc2N(Cc2cc(F)cc(F)c2)S1(=O)=O

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 2/20 0.38
PTGER2 P43116 2/20 0.38
P2RY14 Q15391 1/20 0.35
POLB P06746 1/20 0.34
MYC P01106 2/20 0.33
NTRK1 P04629 2/20 0.33
NTRK3 Q16288 1/20 0.33
NTRK2 Q16620 1/20 0.33
HTR7 P34969 1/20 0.33
LMNA P02545 1/20 0.33
STING1 Q86WV6 1/20 0.32
ENPP2 Q13822 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
DRD2 P14416 1/20 0.32
DRD4 P21917 1/20 0.32
MAPK14 Q16539 1/20 0.32

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
SCHEMBL21932317 0.89 ATM (0.40) POLBNTRK1NTRK3NTRK2LMNA
SCHEMBL31065634 0.89 ATM (0.40) POLBNTRK1NTRK3NTRK2LMNA
SCHEMBL21932204 0.83 STING1 (0.53) STING1
SCHEMBL21932319 0.76 PTGER4 (0.35) PTGER4PTGER2P2RY14POLBMYC
SCHEMBL21932471 0.76 LMNA (0.40) POLBMYCLMNA
SCHEMBL28415044 0.76 PTGER4 (0.39) PTGER4PTGER2P2RY14POLBMYC
SCHEMBL31065615 0.76 HDAC6 (0.41) PTGER4PTGER2P2RY14POLBHTR7
SCHEMBL21932498 0.76 HDAC6 (0.41) PTGER4PTGER2P2RY14POLBHTR7
SCHEMBL24296018 0.74 PTGER4 (0.37) PTGER4PTGER2P2RY14POLBMYC
SCHEMBL21905633 0.70 ATM (0.39) POLBLMNAHDAC1HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111132972-B Small molecule modulators of human STING 克拉德夫制药有限公司 2024-07-12 CN disclosed
US-11571423-B2 Small molecule modulators of human sting CURADEV PHARMA LIMITED (GB) 2023-02-07 US disclosed
US-11571423-B2 Small molecule modulators of human sting CURADEV PHARMA LIMITED (GB) 2023-02-07 US disclosed
EP-3642198-B1 SMALL MOLECULE MODULATORS OF HUMAN STING CURADEV PHARMA LTD (GB) 2022-03-16 EP disclosed
EP-3642198-B1 SMALL MOLECULE MODULATORS OF HUMAN STING CURADEV PHARMA LTD (GB) 2022-03-16 EP disclosed
US-20200147083-A1 SMALL MOLECULE MODULATORS OF HUMAN STING CURADEV PHARMA LIMITED (GB) 2020-05-14 US disclosed
US-20200147083-A1 SMALL MOLECULE MODULATORS OF HUMAN STING CURADEV PHARMA LIMITED (GB) 2020-05-14 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 (2 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-11571423-B2 Small molecule modulators of human sting STING1, IRF3, CGAS PTGER4 2258/4885PTGER2 1072/4885P2RY14 932/4885
US-20200147083-A1 SMALL MOLECULE MODULATORS OF HUMAN STING STING1, IRF3, CGAS PTGER4 2258/4885PTGER2 1072/4885P2RY14 932/4885

“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.