SCHEMBL30478237

SCHEMBL30478237

[2H]c1c([2H])c([2H])c(C(=O)c2cc(Cl)ccc2NC(=O)OC(C)(C)C)c([2H])c1[2H]

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.43
TP53 P04637 4/20 0.42
ALDH1A1 P00352 2/20 0.42
LMNA P02545 2/20 0.42
SERPINE1 P05121 1/20 0.42
SMN1; SMN2 Q16637 3/20 0.41
HSP90AA1 P07900 1/20 0.41
HSP90AB1 P08238 1/20 0.41
THRB P10828 1/20 0.40
GAA P10253 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
KDM4E B2RXH2 1/20 0.40
HSD17B10 Q99714 1/20 0.40

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
SCHEMBL8258036 0.82 SLC10A6 (0.50) MAPTTP53ALDH1A1LMNASERPINE1
SCHEMBL18095007 0.81 MAPT (0.52) MAPTTP53ALDH1A1LMNASERPINE1
SCHEMBL19863788 0.80 ALDH1A1 (0.46) MAPTTP53ALDH1A1LMNASERPINE1
SCHEMBL29259910 0.79 KDM4E (0.63) ALDH1A1SERPINE1HSP90AA1HSP90AB1GAA
SCHEMBL24269577 0.78 ATR (0.53) ALDH1A1SERPINE1HSP90AA1HSP90AB1GAA
SCHEMBL19863786 0.78 CCR9 (0.54) MAPTTP53ALDH1A1LMNASERPINE1
SCHEMBL19857846 0.78 CCR9 (0.57) MAPTTP53ALDH1A1LMNASMN1; SMN2
SCHEMBL30478220 0.78 HSP90AA1 (0.38) LMNASERPINE1SMN1; SMN2HSP90AA1HSP90AB1
SCHEMBL21758801 0.76 RXFP1 (0.46) MAPTTP53ALDH1A1LMNASERPINE1
SCHEMBL3787046 0.76 KMT2A (0.54) MAPTHSP90AA1HSP90AB1GAACYP1A2

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
US-12433896-B2 Deuterated analogs of etifoxine, their derivatives and uses thereof GABA THERAPEUTICS INC. (US) 2025-10-07 US disclosed
US-20230263805-A1 DEUTERATED ANALOGS OF ETIFOXINE, THEIR DERIVATIVES AND USES THEREOF GABA THERAPEUTICS INC (US) 2023-08-24 US disclosed
US-11672805-B2 Deuterated analogs of etifoxine, their derivatives and uses thereof GABA THERAPEUTICS INC. (US) 2023-06-13 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 (3 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-12433896-B2 Deuterated analogs of etifoxine, their derivatives and uses thereof CYP2F1, CYP3A5, CYP4F3 MAPT 3965/4885TP53 2248/4885ALDH1A1 1324/4885
US-11672805-B2 Deuterated analogs of etifoxine, their derivatives and uses thereof CYP2F1, CYP3A5, CYP4F3 MAPT 3965/4885TP53 2248/4885ALDH1A1 1324/4885
US-20230263805-A1 DEUTERATED ANALOGS OF ETIFOXINE, THEIR DERIVATIVES AND USES THEREOF CYP2F1, CYP3A5, CYP4F3 MAPT 3965/4885TP53 2248/4885ALDH1A1 1324/4885

“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.