SCHEMBL22776455

SCHEMBL22776455

CC(C)n1nc(C(=O)NC23CC(CC(=O)O)(C2)C3)c2c(Cc3ccc(C(F)(F)F)cc3)cccc21

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ HTR4 Q13639 11/20 0.34
▸ KCNH2 Q12809 1/20 0.34
▸ NPY5R Q15761 1/20 0.33
▸ PTGER4 P35408 1/20 0.33
▸ EGLN1 Q9GZT9 1/20 0.33
▸ FTO Q9C0B1 1/20 0.32
▸ TRPV1 Q8NER1 1/20 0.32
▸ HIF1A Q16665 2/20 0.31
▸ EPAS1 Q99814 2/20 0.31
▸ HTR2A P28223 1/20 0.31
▸ AURKA O14965 1/20 0.31
▸ AURKB Q96GD4 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
SCHEMBL22777101 0.92 HTR4 (0.36) HTR4KCNH2NPY5RPTGER4TRPV1
SCHEMBL22777088 0.89 PTGER4 (0.35) NPY5RPTGER4EGLN1HIF1AEPAS1
SCHEMBL22776425 0.88 PTGER4 (0.36) NPY5RPTGER4EGLN1
SCHEMBL29614425 0.88 PTGER4 (0.36) NPY5RPTGER4EGLN1
SCHEMBL22791298 0.86 HTR4 (0.33) HTR4KCNH2NPY5RPTGER4EGLN1
SCHEMBL22776609 0.81 LDHA (0.39) HTR4NPY5RPTGER4FTOTRPV1
SCHEMBL29527167 0.81 LDHA (0.39) HTR4NPY5RPTGER4FTOTRPV1
SCHEMBL22776491 0.81 FPR1 (0.33) PTGER4
SCHEMBL22777090 0.79 PDE4A (0.37) PTGER4HIF1AEPAS1
SCHEMBL22776728 0.79 HIF1A (0.35) EGLN1FTOHIF1AEPAS1HTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220324803-A1 PROSTAGLANDIN E2 RECEPTOR 4 ANTAGONISTS AND USES THEREOF TEON THERAPEUTICS INC (US) 2022-10-13 — — US disclosed
EP-3983412-A1 PROSTAGLANDIN E2 RECEPTOR 4 ANTAGONISTS AND USES THEREOF Teon Therapeutics, Inc. (US) 2022-04-20 — — EP disclosed
WO-2020251957-A1 PROSTAGLANDIN E2 RECEPTOR 4 ANTAGONISTS AND USES THEREOF TEON THERAPEUTICS, INC. (US) 2020-12-17 — — WO disclosed
WO-2020251957-A1 PROSTAGLANDIN E2 RECEPTOR 4 ANTAGONISTS AND USES THEREOF TEON THERAPEUTICS, INC. (US) 2020-12-17 — — 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 (1 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-20220324803-A1 PROSTAGLANDIN E2 RECEPTOR 4 ANTAGONISTS AND USES THEREOF PTGER4, PTGER1, PTGER2 HTR4 70/4885KCNH2 4121/4885NPY5R 500/4885

“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.

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