SCHEMBL25952840

SCHEMBL25952840

COC(=O)[C@@H]1CCN(c2cc(F)c(-c3ccc(C)nc3OCc3ccccc3)c(F)c2)C1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.39
▸ LTA4H P09960 1/20 0.39
▸ CNR1 P21554 1/20 0.38
▸ CNR2 P34972 1/20 0.38
▸ PDK2 Q15119 1/20 0.38
▸ F10 P00742 1/20 0.38
▸ GPBAR1 Q8TDU6 1/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ MAPT P10636 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ RXFP1 Q9HBX9 1/20 0.37
▸ S1PR5 Q9H228 1/20 0.37
▸ CHRM4 P08173 1/20 0.36
▸ IDH1 O75874 1/20 0.36
▸ CHRM2 P08172 1/20 0.36

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
SCHEMBL25957189 0.92 LTA4H (0.39) KDM4ELTA4HPDK2F10ALDH1A1
SCHEMBL28899818 0.92 LTA4H (0.39) KDM4ELTA4HPDK2F10ALDH1A1
SCHEMBL25952841 0.92 NOTUM (0.44) KDM4ECNR1CNR2F10ALDH1A1
SCHEMBL24207632 0.87 ACACB (0.37) KDM4ELTA4HPDK2F10ALDH1A1
SCHEMBL26044689 0.86 LTA4H (0.41) KDM4ELTA4HCNR1PDK2F10
SCHEMBL26171398 0.85 S1PR5 (0.39) CNR1S1PR5
SCHEMBL25952842 0.84 S1PR5 (0.35) CNR1CNR2ALDH1A1S1PR5IDH1
SCHEMBL31155491 0.83 CCNT1 (0.37) F10S1PR5CHRM4CHRM2
SCHEMBL25339552 0.83 NOTUM (0.44) F10S1PR5
SCHEMBL25339547 0.83 NOTUM (0.44) F10S1PR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230265116-A1 DEGRADATION OF (EGFR) BY CONJUGATION OF EGFR INHIBITORS WITH E3 LIGASE LIGAND AND METHODS OF USE BEONE MEDICINES I GMBH (CH) 2023-08-24 — — US disclosed
US-20230248834-A1 DEGRADATION OF (EGFR) BY CONJUGATION OF EGFR INHIBITORS WITH E3 LIGASE LIGAND AND METHODS OF USE BEONE MEDICINES I GMBH (CH) 2023-08-10 — — 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-20230265116-A1 DEGRADATION OF (EGFR) BY CONJUGATION OF EGFR INHIBITORS WITH E3 LIGASE LIGAND AND METHODS OF USE EGFR, CBL, ERBB2 KDM4E 1783/4885LTA4H 3854/4885CNR1 4092/4885
US-20230248834-A1 DEGRADATION OF (EGFR) BY CONJUGATION OF EGFR INHIBITORS WITH E3 LIGASE LIGAND AND METHODS OF USE EGFR, CBL, ERBB2 KDM4E 1783/4885LTA4H 3854/4885CNR1 4092/4885

“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.

Send feedback