SCHEMBL31214342

SCHEMBL31214342

Cc1ccnc(SC2CC2)c1CO

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ NOS2 P35228 2/20 0.36
▸ NOS3 P29474 1/20 0.36
▸ FFAR4 Q5NUL3 9/20 0.34
▸ HCRTR2 O43614 2/20 0.33
▸ ABL1 P00519 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
SCHEMBL31214440 0.85 NOS2 (0.35) NOS2NOS3HCRTR2
SCHEMBL31214428 0.78 NOS2 (0.33) NOS2NOS3
SCHEMBL31214396 0.76 HCRTR2 (0.32) NOS2NOS3HCRTR2
SCHEMBL31214442 0.74 HCRTR2 (0.42) FFAR4HCRTR2
SCHEMBL31214520 0.72 NOS2 (0.38) NOS2NOS3ABL1
SCHEMBL31214381 0.71 NOS2 (0.34) NOS2NOS3
SCHEMBL305502 0.70 NOS2 (0.45) NOS2NOS3
SCHEMBL31150926 0.70 NOS2 (0.45) NOS2NOS3
SCHEMBL31214347 0.70 NOS2 (0.36) NOS2NOS3
SCHEMBL31214517 0.70 OPRL1 (0.38) NOS2NOS3

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 NOS2 3832/4885NOS3 2918/4885FFAR4 1940/4885

“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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