SCHEMBL24895767

SCHEMBL24895767

COC(=O)C1(c2ccnc(SC)n2)CC2(C1)OCCO2

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ FFAR4 Q5NUL3 1/20 0.34
▸ PIK3CA P42336 2/20 0.32
▸ ACACB O00763 1/20 0.31
▸ CCNT1 O60563 1/20 0.31
▸ CCNA2 P20248 1/20 0.31
▸ CDK2 P24941 1/20 0.31
▸ CDK9 P50750 1/20 0.31
▸ CCNA1 P78396 1/20 0.31
▸ CDK5 Q00535 1/20 0.31
▸ CDK5R1 Q15078 1/20 0.31
▸ DYRK3 O43781 1/20 0.30
▸ DYRK1A Q13627 1/20 0.30
▸ DYRK2 Q92630 1/20 0.30
▸ PDE4B Q07343 2/20 0.30
▸ PDE4A P27815 1/20 0.30
▸ PDE4C Q08493 1/20 0.30
▸ PDE4D Q08499 1/20 0.30
▸ PDE3B Q13370 1/20 0.30
▸ PDE11A Q9HCR9 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
SCHEMBL24848905 0.91 FFAR4 (0.34) FFAR4PIK3CAACACBCCNT1CCNA2
SCHEMBL21392151 0.83 FFAR4 (0.37) FFAR4PIK3CAPDE4BPDE4APDE4C
SCHEMBL22758510 0.81 FFAR4 (0.36) FFAR4PIK3CAACACBCCNT1CCNA2
SCHEMBL24849581 0.80 MMP2 (0.33) PDE4B
SCHEMBL22758512 0.78 FFAR4 (0.35) FFAR4PIK3CAACACBCCNT1CCNA2
SCHEMBL24849318 0.76 FFAR4 (0.34) FFAR4PIK3CACCNT1CCNA2CDK2
SCHEMBL22762262 0.75 CTPS1 (0.43) —
SCHEMBL22762471 0.72 L3MBTL1 (0.34) PDE4B
SCHEMBL28944831 0.71 ATM (0.42) CCNA2CDK2
SCHEMBL22758556 0.71 FFAR4 (0.39) FFAR4PDE4BPDE4APDE4CPDE4D

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-20230020663-A1 SULFONAMIDE INHIBITORS AS CTPS1 INHIBITORS STEP PHARMA S.A.S. (FR) 2023-01-19 — — 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-20230020663-A1 SULFONAMIDE INHIBITORS AS CTPS1 INHIBITORS CTPS1, CTPS2, TYMS FFAR4 4658/4885PIK3CA 423/4885ACACB 354/4885

“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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