SCHEMBL31214488

SCHEMBL31214488

COc1ccnc(C(F)(F)F)c1CSc1nc2c(c(=O)[nH]1)CCC2

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 7/20 0.52
▸ MMP13 P45452 3/20 0.52
▸ CYP1A2 P05177 2/20 0.52
▸ CYP2C9 P11712 2/20 0.52
▸ CYP2C19 P33261 2/20 0.52
▸ TP53 P04637 3/20 0.51
▸ LMNA P02545 2/20 0.51
▸ MAPT P10636 5/20 0.50
▸ TSHR P16473 2/20 0.49
▸ MAPK1 P28482 1/20 0.48
▸ SPR P35270 1/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ KMT2A Q03164 1/20 0.46

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
SCHEMBL31214531 0.88 HPGD (0.58) HPGDMMP13CYP1A2CYP2C9CYP2C19
SCHEMBL31214422 0.88 MAPT (0.48) HPGDMMP13CYP1A2CYP2C9CYP2C19
SCHEMBL31214533 0.87 MAPT (0.55) HPGDMMP13CYP1A2CYP2C9CYP2C19
SCHEMBL31214496 0.86 HPGD (0.55) HPGDMMP13CYP1A2CYP2C9CYP2C19
SCHEMBL31150961 0.86 HPGD (0.58) HPGDMMP13CYP1A2CYP2C9CYP2C19
SCHEMBL31214443 0.86 HPGD (0.55) HPGDMMP13CYP1A2CYP2C9CYP2C19
SCHEMBL31214495 0.86 HPGD (0.55) HPGDMMP13CYP1A2CYP2C9CYP2C19
SCHEMBL31214560 0.85 HPGD (0.57) HPGDMMP13CYP1A2CYP2C9CYP2C19
SCHEMBL31214457 0.85 HPGD (0.52) HPGDMMP13CYP1A2CYP2C9CYP2C19
SCHEMBL31214484 0.84 HPGD (0.53) HPGDMMP13CYP1A2CYP2C9CYP2C19

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 HPGD 2883/4885MMP13 3831/4885CYP1A2 2385/4885

“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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