SCHEMBL25460876

SCHEMBL25460876

CNC(=O)C(C)(C)c1cc(N)cc(F)c1

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ HDAC3 O15379 1/20 0.34
▸ NCOR2 Q9Y618 1/20 0.34
▸ SLC6A3 Q01959 1/20 0.32
▸ TACR1 P25103 1/20 0.31
▸ KCNN4 O15554 1/20 0.31
▸ LDHA P00338 1/20 0.31
▸ MAPT P10636 1/20 0.30
▸ LTB4R Q15722 1/20 0.30
▸ LTB4R2 Q9NPC1 1/20 0.30

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
SCHEMBL25460811 0.88 SLC6A3 (0.40) HDAC3NCOR2SLC6A3TACR1KCNN4
SCHEMBL25460807 0.83 CNR2 (0.35) HDAC3SLC6A3TACR1MAPTLTB4R
SCHEMBL25460880 0.81 CA12 (0.40) SLC6A3TACR1MAPTLTB4RLTB4R2
SCHEMBL25460884 0.81 MAPT (0.49) HDAC3TACR1MAPT
SCHEMBL25460797 0.81 PARP1 (0.39) HDAC3NCOR2SLC6A3KCNN4
SCHEMBL25464763 0.80 CACNA1B (0.38) —
SCHEMBL25460808 0.79 HCAR1 (0.44) HDAC3NCOR2SLC6A3TACR1
SCHEMBL25460883 0.78 AKR1C3 (0.39) MAPT
SCHEMBL25460768 0.76 PDK1 (0.35) —
SCHEMBL30058308 0.75 SLC6A3 (0.39) HDAC3NCOR2SLC6A3TACR1KCNN4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230151074-A1 MODULATORS OF G-PROTEIN COUPLED RECEPTORS CARMOT THERAPEUTICS, INC. 2023-05-18 — — 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-20230151074-A1 MODULATORS OF G-PROTEIN COUPLED RECEPTORS GIPR, GLP1R, GCGR HDAC3 1173/4885NCOR2 338/4885SLC6A3 741/4885

“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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