SCHEMBL22208486

SCHEMBL22208486

COc1cc(F)ccc1-c1ccc(C(F)(F)F)cc1C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.48
ALDH1A1 P00352 2/20 0.48
HPGD P15428 2/20 0.48
HSD17B10 Q99714 2/20 0.48
USP2 O75604 1/20 0.48
CYP2C19 P33261 1/20 0.48
GPBAR1 Q8TDU6 6/20 0.47
AKR1C3 P42330 3/20 0.46
AKR1C2 P52895 3/20 0.46
SCN8A Q9UQD0 3/20 0.46
SCN10A Q9Y5Y9 3/20 0.46
CTSA P10619 1/20 0.44
LIPG Q9Y5X9 1/20 0.43

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
SCHEMBL31697139 1.00 KDM4E (0.48) KDM4EALDH1A1HPGDHSD17B10USP2
SCHEMBL22208625 0.91 KDM4E (0.50) KDM4EALDH1A1HPGDHSD17B10USP2
SCHEMBL31697082 0.91 KDM4E (0.50) KDM4EALDH1A1HPGDHSD17B10USP2
SCHEMBL29786753 0.89 SCN8A (0.48) GPBAR1AKR1C3AKR1C2SCN8ASCN10A
SCHEMBL22208882 0.88 CFTR (0.51) KDM4EALDH1A1HPGDGPBAR1AKR1C3
SCHEMBL31697102 0.88 CFTR (0.51) KDM4EALDH1A1HPGDGPBAR1AKR1C3
SCHEMBL22208780 0.82 CFTR (0.53) KDM4EALDH1A1HPGDGPBAR1AKR1C3
SCHEMBL31697222 0.82 CFTR (0.53) KDM4EALDH1A1HPGDGPBAR1AKR1C3
SCHEMBL22853079 0.81 MPO (0.57) KDM4EALDH1A1HPGDHSD17B10USP2
SCHEMBL30294712 0.81 MPO (0.57) KDM4EALDH1A1HPGDHSD17B10USP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12441703-B2 Carboxamides as modulators of sodium channels VERTEX PHARMACEUTICALS INCORPORATED (US) 2025-10-14 US disclosed
US-20230062053-A1 CARBOXAMIDES AS MODULATORS OF SODIUM CHANNELS VERTEX PHARMACEUTICALS INCORPORATED 2023-03-02 US disclosed
US-20230062053-A1 CARBOXAMIDES AS MODULATORS OF SODIUM CHANNELS VERTEX PHARMACEUTICALS INCORPORATED 2023-03-02 US disclosed
WO-2020146682-A1 CARBOXAMIDES AS MODULATORS OF SODIUM CHANNELS VERTEX PHARMACEUTICALS INCORPORATED (US) 2020-07-16 WO disclosed
WO-2020146682-A1 CARBOXAMIDES AS MODULATORS OF SODIUM CHANNELS VERTEX PHARMACEUTICALS INCORPORATED (US) 2020-07-16 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 (2 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-12441703-B2 Carboxamides as modulators of sodium channels TRPV1, SCN2A, SCN10A KDM4E 1582/4885ALDH1A1 2665/4885HPGD 1512/4885
US-20230062053-A1 CARBOXAMIDES AS MODULATORS OF SODIUM CHANNELS TRPV1, SCN2A, SCN10A KDM4E 1582/4885ALDH1A1 2665/4885HPGD 1512/4885

“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.