SCHEMBL27112680

SCHEMBL27112680

CC(C)(C)CSc1ccc(C#N)cc1F

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC22A12 Q96S37 2/20 0.39
▸ KIF11 P52732 2/20 0.35
▸ MAOA P21397 1/20 0.35
▸ MAOB P27338 1/20 0.35
▸ AR P10275 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ NR3C1 P04150 1/20 0.34
▸ PGR P06401 1/20 0.34
▸ NR3C2 P08235 1/20 0.34
▸ TRPV4 Q9HBA0 1/20 0.33
▸ MPO P05164 1/20 0.33
▸ SLC6A2 P23975 1/20 0.33
▸ SLC6A4 P31645 1/20 0.33
▸ SLC6A3 Q01959 1/20 0.33
▸ FFAR1 O14842 1/20 0.33
▸ FFAR4 Q5NUL3 1/20 0.33
▸ CYP2A6 P11509 1/20 0.32
▸ CSNK1D P48730 1/20 0.32
▸ CSNK1G2 P78368 1/20 0.32
▸ GPR119 Q8TDV5 1/20 0.32

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
SCHEMBL27110090 0.83 — —
SCHEMBL27110091 0.77 KIF11 (0.35) KIF11SLC6A2SLC6A4SLC6A3
SCHEMBL4032639 0.77 KMT2A (0.44) SLC22A12KIF11ARL3MBTL1CYP2A6
SCHEMBL30846771 0.77 KMT2A (0.44) SLC22A12KIF11ARL3MBTL1CYP2A6
SCHEMBL8111127 0.77 CA2 (0.51) SLC22A12MAOAMAOBARMPO
SCHEMBL30686452 0.76 KIF11 (0.38) SLC22A12KIF11MAOAMAOBAR
SCHEMBL27117919 0.76 KIF11 (0.38) SLC22A12KIF11MAOAMAOBAR
SCHEMBL27112681 0.76 CCR2 (0.39) L3MBTL1SLC6A2SLC6A4SLC6A3
SCHEMBL7897191 0.74 MAOB (0.57) MAOAMAOBL3MBTL1
SCHEMBL4420424 0.73 MAPT (0.56) L3MBTL1

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-20240067630-A1 ARYL ETHER-SUBSTITUTED HETEROCYCLIC COMPOUNDS AS GLP1R AGONISTS MINDRANK AI LTD. (CN) 2024-02-29 — — 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-20240067630-A1 ARYL ETHER-SUBSTITUTED HETEROCYCLIC COMPOUNDS AS GLP1R AGONISTS GLP1R, GIPR, GCGR SLC22A12 981/4885KIF11 1494/4885MAOA 3076/4885

“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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