SCHEMBL25460811

SCHEMBL25460811

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

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC6A3 Q01959 1/20 0.40
▸ CES2 O00748 1/20 0.37
▸ CES1 P23141 1/20 0.37
▸ TACR1 P25103 2/20 0.35
▸ MAPT P10636 2/20 0.34
▸ MEN1 O00255 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ XBP1 P17861 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ LTB4R Q15722 1/20 0.33
▸ LTB4R2 Q9NPC1 1/20 0.33
▸ TACR3 P29371 1/20 0.32
▸ HDAC3 O15379 1/20 0.32
▸ NCOR2 Q9Y618 1/20 0.32
▸ KCNN4 O15554 1/20 0.32
▸ NTRK1 P04629 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
SCHEMBL25460807 0.91 CNR2 (0.35) SLC6A3TACR1MAPTMEN1NPC1
SCHEMBL25460880 0.89 CA12 (0.40) SLC6A3TACR1MAPTMEN1NPC1
SCHEMBL25460884 0.89 MAPT (0.49) CES2TACR1MAPTTACR3HDAC3
SCHEMBL25460876 0.88 HDAC3 (0.34) SLC6A3TACR1MAPTLTB4RLTB4R2
SCHEMBL25460808 0.86 HCAR1 (0.44) SLC6A3CES2CES1TACR1MEN1
SCHEMBL25460883 0.85 AKR1C3 (0.39) MAPTNPC1RAB9AALDH1A1GAA
SCHEMBL25460797 0.85 PARP1 (0.39) SLC6A3CES2CES1HDAC3NCOR2
SCHEMBL25460768 0.84 PDK1 (0.35) —
SCHEMBL30058308 0.82 SLC6A3 (0.39) SLC6A3CES2CES1TACR1MAPT
SCHEMBL25460886 0.82 TRPV1 (0.36) SMN1; SMN2

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 SLC6A3 741/4885CES2 4245/4885CES1 3884/4885

“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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