SCHEMBL31249873

SCHEMBL31249873

C[C@]12CCC(=O)C=C1CC[C@@H]1[C@@H]2[C@@H](O)C[C@@]2(C)[C@H]1CC[C@]2(O)C(=O)COC(=O)CCCN

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HIF1A Q16665 12/20 0.84
▸ SMN1; SMN2 Q16637 3/20 0.84
▸ MAPT P10636 2/20 0.84
▸ POLB P06746 1/20 0.84
▸ GAA P10253 1/20 0.84
▸ NFKB1 P19838 2/20 0.80
▸ PMP22 Q01453 1/20 0.80
▸ TSHR P16473 1/20 0.80
▸ PGR P06401 3/20 0.77
▸ LMNA P02545 3/20 0.77
▸ SERPINA6 P08185 2/20 0.77
▸ AR P10275 2/20 0.77
▸ CHRM1 P11229 2/20 0.77
▸ CYP3A4 P08684 2/20 0.75
▸ NR3C1 P04150 3/20 0.70
▸ NR3C2 P08235 3/20 0.70
▸ CYP2C19 P33261 2/20 0.70
▸ HSD17B10 Q99714 2/20 0.70
▸ KMT2A Q03164 2/20 0.70
▸ SHBG P04278 1/20 0.70

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
Hydrochloric Acid SCHEMBL31249826 0.99 HIF1A (0.83) HIF1ASMN1; SMN2MAPTPOLBGAA
SCHEMBL31249840 0.98 HIF1A (0.85) HIF1ASMN1; SMN2MAPTPOLBGAA
Hydrochloric Acid SCHEMBL31249720 0.97 HIF1A (0.84) HIF1ASMN1; SMN2MAPTPOLBGAA
SCHEMBL31249760 0.97 HIF1A (0.87) HIF1ASMN1; SMN2MAPTPOLBGAA
Hydrochloric Acid SCHEMBL31249708 0.96 HIF1A (0.85) HIF1ASMN1; SMN2MAPTPOLBGAA
SCHEMBL4450347 0.94 HIF1A (0.86) HIF1ASMN1; SMN2MAPTPOLBGAA
SCHEMBL2679288 0.94 HIF1A (0.95) HIF1ASMN1; SMN2MAPTPOLBGAA
SCHEMBL13669679 0.94 HIF1A (0.86) HIF1ASMN1; SMN2MAPTPOLBGAA
SCHEMBL80604 0.94 HIF1A (0.95) HIF1ASMN1; SMN2MAPTPOLBGAA
SCHEMBL16018308 0.93 HIF1A (0.93) HIF1ASMN1; SMN2MAPTPOLBGAA

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-20240398963-A1 DRUG DELIVERY SYSTEM FOR LOCALLY DELIVERING THERAPEUTIC AGENTS AND USES THEREOF COVAL BIOPHARMA (SHANGHAI) CO., LTD. (CN) 2024-12-05 — — 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 (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-20240398963-A1 DRUG DELIVERY SYSTEM FOR LOCALLY DELIVERING THERAPEUTIC AGENTS AND USES THEREOF TIE1, KDR, TEK HIF1A 231/4885SMN1; SMN2 288/4885MAPT 1542/4885

“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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