SCHEMBL31214442

SCHEMBL31214442

Cc1ccnc(SC2CC2)c1C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HCRTR2 O43614 5/20 0.42
▸ FFAR4 Q5NUL3 6/20 0.37
▸ ALDH1A1 P00352 2/20 0.34
▸ CCR5 P51681 3/20 0.33
▸ DDB1 Q16531 1/20 0.33
▸ CRBN Q96SW2 1/20 0.33
▸ SMN1; SMN2 Q16637 3/20 0.33
▸ GAA P10253 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ GLA P06280 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ HIF1A Q16665 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL31214438 0.84 HCRTR2 (0.57) HCRTR2FFAR4GAAKDM4EL3MBTL1
SCHEMBL31214415 0.78 L3MBTL1 (0.42) ALDH1A1SMN1; SMN2GAAKDM4EHTT
SCHEMBL31214342 0.74 NOS2 (0.36) HCRTR2FFAR4
SCHEMBL2130737 0.74 GAA (0.39) ALDH1A1SMN1; SMN2GAAKDM4EHTT
SCHEMBL31214396 0.73 HCRTR2 (0.32) HCRTR2ALDH1A1CCR5SMN1; SMN2
SCHEMBL353204 0.70 KDM4E (0.40) ALDH1A1CCR5SMN1; SMN2KDM4EKMT2A
SCHEMBL31214440 0.70 NOS2 (0.35) HCRTR2
SCHEMBL7612137 0.69 L3MBTL1 (0.38) ALDH1A1CCR5SMN1; SMN2KDM4EKMT2A
SCHEMBL9504653 0.69 KDM4E (0.39) ALDH1A1CCR5SMN1; SMN2KDM4EKMT2A
Hydrochloric Acid SCHEMBL4249059 0.69 KDM4E (0.39) ALDH1A1CCR5SMN1; SMN2KDM4EKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4688754-A1 KCC2 POTENTIATORS AND USES THEREOF Axonis Therapeutics, Inc. (US) 2026-02-11 — — EP disclosed
US-20260028351-A1 KCC2 POTENTIATORS AND USES THEREOF AXONIS THERAPEUTICS, INC. 2026-01-29 — — US disclosed
WO-2024211744-A1 KCC2 POTENTIATORS AND USES THEREOF AXONIS THERAPEUTICS, INC. (US) 2024-10-10 — — WO 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-20260028351-A1 KCC2 POTENTIATORS AND USES THEREOF GRIN2C, HCN1, KCNC1 HCRTR2 113/4885FFAR4 1940/4885ALDH1A1 3779/4885

“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.

Send feedback