SCHEMBL31678866

SCHEMBL31678866

C[C@]1(C(=O)NC(=O)[C@@]2(C)CCC[C@]3(C)c4cc(OP(=O)(O)O)ccc4CC[C@@H]23)CCC[C@]2(C)c3cc(N)ccc3CC[C@@H]12

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ NR1H2 P55055 14/20 0.61
▸ NR1H3 Q13133 14/20 0.61
▸ POLA1 P09884 4/20 0.55
▸ CYP2C9 P11712 1/20 0.46
▸ TSHR P16473 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46
▸ CYP3A4 P08684 1/20 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
SCHEMBL20561165 1.00 NR1H2 (0.61) NR1H2NR1H3POLA1CYP2C9TSHR
SCHEMBL20561735 0.92 NR1H2 (0.58) NR1H2NR1H3POLA1CYP2C9TSHR
SCHEMBL21552174 0.88 NR1H2 (0.77) NR1H2NR1H3POLA1
SCHEMBL20560970 0.83 NR1H2 (0.87) NR1H2NR1H3
SCHEMBL24591986 0.83 NR1H2 (0.69) NR1H2NR1H3POLA1
SCHEMBL24270940 0.83 NR1H2 (0.87) NR1H2NR1H3
SCHEMBL23962014 0.83 NR1H2 (0.87) NR1H2NR1H3
SCHEMBL24591697 0.82 NR1H2 (0.67) NR1H2NR1H3POLA1
SCHEMBL24270700 0.81 NR1H2 (0.66) NR1H2NR1H3CYP2C9TSHRCYP2C19
SCHEMBL21552124 0.81 NR1H2 (0.66) NR1H2NR1H3POLA1

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-20250270163-A1 BIS-OCTAHYDROPHENANTHRENE CARBOXAMIDES AND PROTEIN CONJUGATES THEREOF REGENERON PHARMA (US) 2025-08-28 — — 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-20250270163-A1 BIS-OCTAHYDROPHENANTHRENE CARBOXAMIDES AND PROTEIN CONJUGATES THEREOF NR1H4, NR1H3, OGFR NR1H2 4/4885NR1H3 2/4885POLA1 2752/4885

“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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