SCHEMBL16387353

SCHEMBL16387353

C=C1C[C@H]2C3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@@H](O)C[C@]2(C)[C@]1(O)C#C[Si](C)(C)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HIF1A Q16665 6/20 0.51
▸ LMNA P02545 2/20 0.51
▸ NR3C1 P04150 8/20 0.49
▸ NR3C2 P08235 4/20 0.49
▸ CYP2C19 P33261 3/20 0.49
▸ HSD17B10 Q99714 2/20 0.49
▸ MAPT P10636 2/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ PGR P06401 2/20 0.49
▸ SERPINA6 P08185 2/20 0.49
▸ SMN1; SMN2 Q16637 2/20 0.49
▸ SHBG P04278 1/20 0.49
▸ CYP3A4 P08684 1/20 0.49
▸ NFKB1 P19838 1/20 0.49
▸ CYP1A2 P05177 1/20 0.48
▸ MEN1 O00255 1/20 0.48
▸ GLA P06280 1/20 0.48
▸ AR P10275 1/20 0.46
▸ CHRM1 P11229 1/20 0.46
▸ HSD11B1 P28845 2/20 0.46

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
SCHEMBL16387365 1.00 HIF1A (0.51) HIF1ALMNANR3C1NR3C2CYP2C19
SCHEMBL16387355 0.89 HIF1A (0.57) HIF1ALMNANR3C1NR3C2CYP2C19
SCHEMBL16387364 0.89 HIF1A (0.57) HIF1ALMNANR3C1NR3C2CYP2C19
SCHEMBL16387356 0.85 HIF1A (0.54) HIF1ALMNANR3C1NR3C2CYP2C19
SCHEMBL16387366 0.85 HIF1A (0.54) HIF1ALMNANR3C1NR3C2CYP2C19
SCHEMBL16387349 0.82 HIF1A (0.61) HIF1ALMNANR3C1NR3C2CYP2C19
SCHEMBL15079260 0.82 HIF1A (0.61) HIF1ALMNANR3C1NR3C2CYP2C19
SCHEMBL16389277 0.80 HIF1A (0.54) HIF1ALMNANR3C1NR3C2CYP2C19
SCHEMBL17634428 0.80 HIF1A (0.54) HIF1ALMNANR3C1NR3C2CYP2C19
SCHEMBL17591544 0.79 HIF1A (0.57) HIF1ALMNANR3C1NR3C2CYP2C19

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-20150005518-A1 PROCESS FOR ALKYNYLATING 16-SUBSTITUTED-17-KETO STEROIDS CRYSTAL PHARMA, S.A.U. (ES) 2015-01-01 — — US disclosed
US-20150005518-A1 PROCESS FOR ALKYNYLATING 16-SUBSTITUTED-17-KETO STEROIDS CRYSTAL PHARMA, S.A.U. (ES) 2015-01-01 — — 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-20150005518-A1 PROCESS FOR ALKYNYLATING 16-SUBSTITUTED-17-KETO STEROIDS HSD17B7, NR3C2, CYP17A1 HIF1A 3954/4885LMNA 553/4885NR3C1 12/4885

“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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