SCHEMBL29520167

SCHEMBL29520167

C1=CC2=C(CC1)CCc1ccccc1C2

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 1/20 0.41
DRD2 P14416 3/20 0.35
DRD1 P21728 3/20 0.35
DRD4 P21917 3/20 0.35
DRD5 P21918 3/20 0.35
DRD3 P35462 3/20 0.35
TSHR P16473 1/20 0.34
CYP1A2 P05177 1/20 0.32
HTR2C P28335 1/20 0.31
ANPEP P15144 3/20 0.31
MAOA P21397 1/20 0.30
MAOB P27338 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
SCHEMBL8663476 0.88 CYP1A2 (0.34) CYP2A6DRD2DRD1DRD4DRD5
SCHEMBL3840834 0.85 CYP2A6 (0.41) CYP2A6DRD2DRD1DRD4DRD5
SCHEMBL25834858 0.72 DRD2 (0.33) DRD2DRD1DRD4DRD5DRD3
SCHEMBL17968444 0.71
SCHEMBL8664552 0.69
SCHEMBL8661501 0.69 CES1 (0.47) CYP2A6MAOAMAOB
SCHEMBL22362502 0.69 CHRM2 (0.39) CYP2A6DRD1DRD3CYP1A2MAOA
SCHEMBL25924715 0.69 ACHE (0.32)
SCHEMBL10740554 0.69 CYP2A6 (0.48) CYP2A6DRD2DRD1DRD4DRD5
SCHEMBL250734 0.68 CYP2A6 (0.65) CYP2A6DRD2DRD1DRD4DRD5

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-11324827-B2 Multifunctionalized polyethylene glycol derivative and preparation method therefor XIAMEN SINOPEG BIOTECH CO., LTD. (CN) 2022-05-10 US claimed
US-11324827-B2 Multifunctionalized polyethylene glycol derivative and preparation method therefor XIAMEN SINOPEG BIOTECH CO., LTD. (CN) 2022-05-10 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-11324827-B2 Multifunctionalized polyethylene glycol derivative and preparation method therefor HDGF, F11, F12 CYP2A6 3508/4885DRD2 3203/4885DRD1 2665/4885

“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.