SCHEMBL26941574

SCHEMBL26941574

C=C(CC(=O)OC1(c2ccc(C)cc2)CCC1)C(=O)OC

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 4/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ MAPT P10636 2/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ POLB P06746 1/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ HPGD P15428 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ PKM P14618 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ DRD2 P14416 1/20 0.32
▸ DRD4 P21917 1/20 0.32
▸ DRD3 P35462 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ P2RX7 Q99572 2/20 0.31
▸ OPRD1 P41143 3/20 0.31
▸ OPRK1 P41145 3/20 0.31
▸ HTR2C P28335 1/20 0.31

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
SCHEMBL26941571 0.88 OPRM1 (0.36) OPRM1ALDH1A1MAPTSMN1; SMN2DRD2
SCHEMBL26941609 0.88 ALDH1A1 (0.37) OPRM1ALDH1A1MAPTSMN1; SMN2DRD2
SCHEMBL26958140 0.85 MAPT (0.38) OPRM1ALDH1A1MAPTSMN1; SMN2KDM4E
SCHEMBL24803200 0.85 SLC6A3 (0.38) OPRM1MAPTP2RX7
SCHEMBL26941636 0.85 MAPT (0.39) OPRM1ALDH1A1MAPTSMN1; SMN2KDM4E
SCHEMBL26958143 0.82 OPRM1 (0.38) OPRM1ALDH1A1MAPTSMN1; SMN2DRD2
SCHEMBL29588742 0.82 PDE2A (0.38) SMN1; SMN2
SCHEMBL26941657 0.81 L3MBTL1 (0.35) ALDH1A1MAPTSMN1; SMN2
SCHEMBL24394132 0.81 L3MBTL1 (0.33) ALDH1A1
SCHEMBL26941579 0.77 GSK3B (0.40) OPRM1ALDH1A1MAPTSMN1; SMN2CYP3A4

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-20230399289-A1 ITACONIC ACID DERIVATIVES SITRYX THERAPEUTICS LIMITED (GB) 2023-12-14 — — US disclosed
US-20230399287-A1 NOVEL COMPOUNDS SITRYX THERAPEUTICS LIMITED (GB) 2023-12-14 — — 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 (2 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-20230399287-A1 NOVEL COMPOUNDS CNKSR1, RORC, HLA-DRB1 OPRM1 4344/4885ALDH1A1 182/4885MAPT 4238/4885
US-20230399289-A1 ITACONIC ACID DERIVATIVES IL1R1, LRBA, HCAR1 OPRM1 4873/4885ALDH1A1 28/4885MAPT 3634/4885

“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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