SCHEMBL13181583

SCHEMBL13181583

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)OCC(NC(=O)CCCCCON(O)O)C(=O)OCCCCON(O)O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HIF1A Q16665 10/20 0.62
▸ SMN1; SMN2 Q16637 3/20 0.62
▸ MAPT P10636 2/20 0.62
▸ POLB P06746 1/20 0.62
▸ GAA P10253 1/20 0.62
▸ PGR P06401 3/20 0.60
▸ SERPINA6 P08185 2/20 0.60
▸ LMNA P02545 2/20 0.60
▸ AR P10275 2/20 0.60
▸ CHRM1 P11229 2/20 0.60
▸ CYP3A4 P08684 2/20 0.59
▸ NFKB1 P19838 2/20 0.57
▸ PMP22 Q01453 1/20 0.57
▸ TSHR P16473 1/20 0.57
▸ NR3C1 P04150 6/20 0.54
▸ NR3C2 P08235 3/20 0.54
▸ CYP2C19 P33261 2/20 0.54
▸ HSD17B10 Q99714 2/20 0.54
▸ KMT2A Q03164 2/20 0.54
▸ SHBG P04278 1/20 0.54

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
SCHEMBL13181584 0.95 HIF1A (0.62) HIF1ASMN1; SMN2MAPTPOLBGAA
SCHEMBL13181578 0.92 HIF1A (0.66) HIF1ASMN1; SMN2MAPTPOLBGAA
SCHEMBL13155911 0.91 HIF1A (0.60) HIF1ASMN1; SMN2MAPTPOLBGAA
SCHEMBL13181621 0.89 KMT2A (0.60) HIF1ASMN1; SMN2MAPTPOLBGAA
SCHEMBL13181581 0.88 HIF1A (0.65) HIF1ASMN1; SMN2MAPTPOLBGAA
SCHEMBL13181576 0.86 HIF1A (0.65) HIF1ASMN1; SMN2MAPTPOLBGAA
SCHEMBL13155915 0.86 HIF1A (0.60) HIF1ASMN1; SMN2MAPTPOLBGAA
SCHEMBL13181579 0.85 HIF1A (0.71) HIF1ASMN1; SMN2MAPTPOLBGAA
SCHEMBL13181585 0.85 HIF1A (0.72) HIF1ASMN1; SMN2MAPTPOLBGAA
SCHEMBL13181668 0.84 KMT2A (0.65) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100234334-A1 NITRIC OXIDE RELEASING STEROIDS NICOX S.A. (FR) 2010-09-16 — — US disclosed
WO-2008095809-A1 NITRIC OXIDE RELEASING STEROIDS NICOX S.A. (FR) 2008-08-14 — — 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 (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-20100234334-A1 NITRIC OXIDE RELEASING STEROIDS NOS1, NR3C1, NOS2 HIF1A 887/4885SMN1; SMN2 3945/4885MAPT 4399/4885

“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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