SCHEMBL6744508

SCHEMBL6744508

CCCC(=O)OC1(C)CC2C=CC1C2

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.38
CYP2C19 P33261 1/20 0.38
ALDH1A1 P00352 1/20 0.33
P2RX7 Q99572 1/20 0.31
NLRP3 Q96P20 1/20 0.31
CYP19A1 P11511 2/20 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
SCHEMBL31695291 0.88 CYP2D6 (0.40) CYP2D6CYP2C19P2RX7
SCHEMBL32689135 0.82 CYP2D6 (0.35) CYP2D6CYP2C19P2RX7
SCHEMBL5354586 0.79 CYP2D6 (0.36) CYP2D6CYP2C19ALDH1A1
SCHEMBL7863152 0.79 CYP2D6 (0.36) CYP2D6CYP2C19P2RX7
SCHEMBL5357706 0.79 CYP2D6 (0.38) CYP2D6CYP2C19ALDH1A1
SCHEMBL5360193 0.77 ELANE (0.35) CYP2D6CYP2C19ALDH1A1
SCHEMBL5347779 0.76 CYP2D6 (0.34) CYP2D6CYP2C19P2RX7
SCHEMBL4401669 0.75 ALDH1A1 (0.33) CYP2D6CYP2C19ALDH1A1
SCHEMBL19928619 0.75 CYP2D6 (0.33) CYP2D6CYP2C19P2RX7
SCHEMBL31695324 0.75 CYP2D6 (0.33) CYP2D6CYP2C19P2RX7

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250313523-A1 FRAGRANCE AND FLAVOR COMPOSITIONS COMPRISING NORBORNANE AND NORBORNENE DERIVATIVES OSMO LABS, PBC 2025-10-09 US disclosed
US-6790914-B2 TRANSPARENT (CROSSLINKED) RESIN FILM CAN BE USED AS A POLARIZING FILM, SURFACE PROTECTIVE FILM, RETARDATION FILM, TRANSPARENT CONDUCTIVE FILM, LIGHT DIFFUSION FILM, FILM FOR AN EL DISPLAY DEVICE, TRANSPARENT CONDUCTIVE COMPOSITE MATERIAL, JSR CORPORATION (JP) 2004-09-14 US disclosed
US-20040106740-A1 Resin film and applications thereof JSR CORPORATION (JP) 2004-06-03 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-20250313523-A1 FRAGRANCE AND FLAVOR COMPOSITIONS COMPRISING NORBORNANE AND NORBORNENE DERIVATIVES CYP8B1, CYP1B1, BBOX1 CYP2D6 301/4885CYP2C19 355/4885ALDH1A1 117/4885

“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.