SCHEMBL30290959

SCHEMBL30290959

C#CCCCC(=O)OCCCOC(=O)CCCC#C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.43
CYP2D6 P10635 2/20 0.43
MAPT P10636 2/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
HSD17B10 Q99714 1/20 0.43
DGKA P23743 1/20 0.42
CNR1 P21554 2/20 0.40
CNR2 P34972 1/20 0.40
GSTP1 P09211 1/20 0.39
CYP3A4 P08684 1/20 0.37
ADRA2A P08913 1/20 0.35
ADRA1A P35348 1/20 0.35
TSHR P16473 1/20 0.35
DNM1 Q05193 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
BLM P54132 1/20 0.34
HTR2C P28335 1/20 0.34
PRSS1 P07477 1/20 0.34
PRSS2 P07478 1/20 0.34

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
SCHEMBL10011861 0.91 CYP1A2 (0.43) CYP1A2CYP2D6MAPTCYP2C9CYP2C19
SCHEMBL10011687 0.89 MAPT (0.52) CYP1A2CYP2D6MAPTCYP2C9CYP2C19
SCHEMBL10010053 0.89 MAPT (0.47) CYP1A2CYP2D6MAPTCYP2C9CYP2C19
SCHEMBL18766961 0.89 MAPT (0.45) CYP1A2CYP2D6MAPTCYP2C9CYP2C19
SCHEMBL19362798 0.88 DGKA (0.55) MAPTDGKACNR1CNR2TSHR
SCHEMBL10476535 0.87 MAPT (0.48) CYP1A2CYP2D6MAPTCYP2C9CYP2C19
SCHEMBL10012934 0.87 CNR1 (0.39) CYP1A2CYP2D6MAPTCYP2C9CYP2C19
SCHEMBL10010326 0.85 CNR1 (0.41) CYP1A2CYP2D6MAPTCYP2C9CYP2C19
SCHEMBL10011692 0.85 MAPT (0.52) CYP1A2CYP2D6MAPTCYP2C9CYP2C19
SCHEMBL10011989 0.84 DGKA (0.48) CYP1A2CYP2D6MAPTCYP2C9CYP2C19

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-20220401455-A1 BIODEGRADABLE DRUG-POLYMER CONJUGATE POLYACTIVA PTY LTD (AU) 2022-12-22 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-20220401455-A1 BIODEGRADABLE DRUG-POLYMER CONJUGATE PTGER1, PTGDR, F12 CYP1A2 23/4885CYP2D6 68/4885MAPT 4025/4885

“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.