SCHEMBL31675176

SCHEMBL31675176

C[C@@H]1CC2=C(C[C@H]1C)C(C)(C)CCC2

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.56
▸ ALDH1A1 P00352 3/20 0.53
▸ TDP1 Q9NUW8 1/20 0.53
▸ NPSR1 Q6W5P4 2/20 0.52
▸ GAA P10253 1/20 0.52
▸ ALOX12 P18054 1/20 0.52
▸ AGTR1 P30556 1/20 0.52
▸ HTT P42858 1/20 0.52
▸ SLC2A1 P11166 1/20 0.50
▸ MCL1 Q07820 3/20 0.46
▸ LMNA P02545 2/20 0.37
▸ HPGD P15428 1/20 0.37
▸ CCR6 P51684 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.36
▸ CYP1A2 P05177 1/20 0.30

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
SCHEMBL869519 1.00 POLB (0.56) POLBALDH1A1TDP1NPSR1GAA
SCHEMBL31454136 0.75 SLC2A1 (0.51) POLBALDH1A1TDP1NPSR1GAA
SCHEMBL18834394 0.75 ALDH1A1 (0.46) POLBALDH1A1TDP1NPSR1GAA
SCHEMBL12326607 0.75 MCL1 (0.67) POLBALDH1A1TDP1NPSR1GAA
SCHEMBL2958620 0.74 ALDH1A1 (0.45) POLBALDH1A1TDP1NPSR1GAA
SCHEMBL12858698 0.71 ALDH1A1 (0.57) POLBALDH1A1TDP1NPSR1GAA
SCHEMBL4079229 0.71 ALDH1A1 (0.58) POLBALDH1A1TDP1NPSR1GAA
SCHEMBL14001694 0.70 ALDH1A1 (1.00) POLBALDH1A1TDP1NPSR1GAA
SCHEMBL19924617 0.70 ALDH1A1 (1.00) POLBALDH1A1TDP1NPSR1GAA
SCHEMBL3505752 0.70 ALDH1A1 (0.78) POLBALDH1A1TDP1NPSR1GAA

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-20250263629-A1 MUSKY ODORANT FIRMENICH SA (CH) 2025-08-21 — — 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-20250263629-A1 MUSKY ODORANT TRPA1, MSMO1, MSH2 POLB 945/4885ALDH1A1 161/4885TDP1 2647/4885

“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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