SCHEMBL23451698

SCHEMBL23451698

FC1CN(c2ccc(-c3nnco3)cc2C(F)(F)F)C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 18/20 1.00
PDE3B Q13370 1/20 0.41
PDE3A Q14432 1/20 0.41
KDM4E B2RXH2 1/20 0.41
LMNA P02545 1/20 0.41

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
SCHEMBL30412199 1.00 NOTUM (1.00) NOTUMPDE3BPDE3AKDM4ELMNA
SCHEMBL23451688 0.90 NOTUM (1.00) NOTUMKDM4ELMNA
SCHEMBL21776876 0.82 NOTUM (1.00) NOTUMPDE3BPDE3AKDM4ELMNA
SCHEMBL30411560 0.79 NOTUM (0.65) NOTUMPDE3BPDE3A
SCHEMBL21776956 0.79 NOTUM (0.65) NOTUMPDE3BPDE3A
SCHEMBL21776971 0.76 NOTUM (1.00) NOTUMKDM4ELMNA
SCHEMBL29366138 0.75 NOTUM (0.76) NOTUMKDM4ELMNA
SCHEMBL21776815 0.74 NOTUM (1.00) NOTUMKDM4ELMNA
SCHEMBL21776973 0.74 NOTUM (1.00) NOTUM
SCHEMBL30412767 0.74 NOTUM (1.00) NOTUM

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-11634391-B2 Compounds which are inhibitors of Notum UCL BUSINESS LTD (GB) 2023-04-25 US disclosed
US-20210171475-A1 COMPOUNDS UCL BUSINESS LTD (GB) 2021-06-10 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-11634391-B2 Compounds which are inhibitors of Notum NOTUM, GOT2, GOT1 NOTUM 1/4885PDE3B 2419/4885PDE3A 2680/4885
US-20210171475-A1 COMPOUNDS GOT2, GOT1, OAT NOTUM 5/4885PDE3B 2690/4885PDE3A 3140/4885

“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.