SCHEMBL6038122

SCHEMBL6038122

Nc1ccc(SCC(=O)NCCCCCCN(C(=O)C(F)(F)F)c2nc3c(F)cc(F)cc3s2)cc1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.38
▸ THRB P10828 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ POLB P06746 2/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ HTT P42858 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ PAX8 Q06710 1/20 0.36
▸ OPRM1 P35372 2/20 0.36
▸ OPRD1 P41143 2/20 0.36
▸ TP53 P04637 3/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ LMNA P02545 4/20 0.35
▸ RAB9A P51151 1/20 0.34
▸ NPC1 O15118 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
SCHEMBL5275858 0.84 SMN1; SMN2 (0.41) MAPTGAAPOLBALDH1A1HTT
Trifluoroacetic Acid SCHEMBL6038121 0.79 NPC1 (0.49) MAPTGAAALDH1A1HTTTP53
Trifluoroacetic Acid SCHEMBL5275853 0.64 HDAC1 (0.60) MAPTPOLBALDH1A1KDM4EHPGD
Hydrochloric Acid SCHEMBL5288425 0.60 MAPT (0.63) MAPTPOLBALDH1A1HTTKDM4E
SCHEMBL6038034 0.60 AKR1C3 (0.61) GAAALDH1A1KDM4E
SCHEMBL6038024 0.59 HDAC1 (0.61) MAPTPOLBALDH1A1HTTKDM4E
SCHEMBL6037907 0.59 NPC1 (0.47) KMT2ARAB9ANPC1
SCHEMBL5275476 0.59 ALDH1A1 (0.63) MAPTPOLBALDH1A1HTTKDM4E
SCHEMBL7839582 0.58 HTT (0.46) MAPTPOLBALDH1A1HTTHPGD
SCHEMBL6038042 0.58 HDAC6 (0.67) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060264415-A1 Inhibitors of histone deacetylase METHYLGENE INC. 2006-11-23 — — US claimed

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-20060264415-A1 Inhibitors of histone deacetylase HDAC1, HDAC3, HDAC11 MAPT 3848/4885THRB 2728/4885GAA 569/4885

“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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