SCHEMBL6442618

SCHEMBL6442618

COC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=C[C@H](O)C=C[C@@H]4[C@H]3CC[C@]12C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.44
▸ LMNA P02545 4/20 0.44
▸ ALDH1A1 P00352 2/20 0.41
▸ MCL1 Q07820 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ HIF1A Q16665 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ SERPINA6 P08185 2/20 0.40
▸ SLC22A1 O15245 1/20 0.40
▸ SHBG P04278 1/20 0.40
▸ THRB P10828 1/20 0.40
▸ CYP3A4 P08684 5/20 0.39
▸ NR1I2 O75469 2/20 0.39
▸ CYP2C19 P33261 2/20 0.39
▸ NR3C1 P04150 1/20 0.39
▸ CYP17A1 P05093 1/20 0.39
▸ PGR P06401 1/20 0.39
▸ AR P10275 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ TSHR P16473 1/20 0.39

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
SCHEMBL6442919 1.00 MAPT (0.44) MAPTLMNAALDH1A1MCL1CYP1A2
SCHEMBL6446120 0.84 LMNA (0.48) MAPTLMNAALDH1A1MCL1CYP1A2
SCHEMBL6441434 0.80 MAPT (0.51) MAPTLMNAALDH1A1MCL1CYP1A2
SCHEMBL6446239 0.80 MAPT (0.51) MAPTLMNAALDH1A1MCL1CYP1A2
SCHEMBL6448612 0.80 ESR1 (0.54) MAPTLMNAALDH1A1CYP1A2HIF1A
SCHEMBL6448737 0.80 ESR1 (0.54) MAPTLMNAALDH1A1CYP1A2HIF1A
SCHEMBL6450159 0.80 ESR1 (0.54) MAPTLMNAALDH1A1CYP1A2HIF1A
SCHEMBL24103254 0.77 MAPT (0.69) MAPTLMNAALDH1A1MCL1CYP1A2
SCHEMBL6445859 0.77 MAPT (0.69) MAPTLMNAALDH1A1MCL1CYP1A2
SCHEMBL6443141 0.76 LMNA (0.47) MAPTLMNAHSD17B10SERPINA6SHBG

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-20050159366-A1 Pharmaceutical compositions and treatment methods - 8 BIOVIE INC. 2005-07-21 — — 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-20050159366-A1 Pharmaceutical compositions and treatment methods - 8 HSD17B7, NR5A1, HSD3B1 MAPT 2579/4885LMNA 4071/4885ALDH1A1 3092/4885

“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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