SCHEMBL26020005

SCHEMBL26020005

O=CCOc1cc(F)ccc1C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CTSS P25774 3/20 0.41
CTSK P43235 3/20 0.41
CTSL P07711 2/20 0.41
RBP4 P02753 1/20 0.39
TTR P02766 1/20 0.39
IDO1 P14902 2/20 0.39
DRD2 P14416 3/20 0.39
MRGPRX4 Q96LA9 2/20 0.37
PPARG P37231 1/20 0.36
P2RY1 P47900 1/20 0.35
KIF11 P52732 1/20 0.35
HTR1A P08908 2/20 0.34
HTR2A P28223 2/20 0.34
HTR7 P34969 2/20 0.34
HTR6 P50406 2/20 0.34
RXRA P19793 1/20 0.33
RXRB P28702 1/20 0.33
RXRG P48443 1/20 0.33

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
SCHEMBL24177162 0.87 MRGPRX4 (0.49) CTSSCTSKCTSLRBP4TTR
SCHEMBL5003721 0.81 RXRA (0.49) CTSSCTSKCTSLRBP4IDO1
SCHEMBL16422054 0.81 MRGPRX1 (0.40) CTSSCTSKCTSL
SCHEMBL24176771 0.80 TUBB1 (0.40) CTSSCTSKCTSLMRGPRX4RXRA
SCHEMBL2555360 0.79 CTSS (0.53) CTSSCTSKCTSL
SCHEMBL3734649 0.76 ADRA1D (0.45) CTSSCTSKCTSLHTR1AHTR2A
SCHEMBL20578753 0.75 POLB (0.50) CTSSCTSKCTSL
SCHEMBL9633635 0.75 TUBB1 (0.54) CTSSCTSKCTSLHTR1A
SCHEMBL24305891 0.75 DRD2 (0.47) CTSSCTSKRBP4TTRIDO1
SCHEMBL17848426 0.75 DRD2 (0.44) RBP4TTRIDO1DRD2MRGPRX4

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-20230257382-A1 HETEROCYCLIC COMPOUND AND USE THEREOF WUHAN LL SCIENCE AND TECHNOLOGY DEVELOPMENT CO., LTD. (CN) 2023-08-17 US disclosed
US-20230257382-A1 HETEROCYCLIC COMPOUND AND USE THEREOF WUHAN LL SCIENCE AND TECHNOLOGY DEVELOPMENT CO., LTD. (CN) 2023-08-17 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 (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-20230257382-A1 HETEROCYCLIC COMPOUND AND USE THEREOF TRPC5, TRPC1, GOT1 CTSS 1049/4885CTSK 1357/4885CTSL 1988/4885

“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.