SCHEMBL21916490

SCHEMBL21916490

C#CCC(CC#C)C(=O)N(C[C@H](O)COc1ccc(CCOCC2CC2)cc1)C(C)C

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ADRB1 P08588 2/20 0.55
LMNA P02545 2/20 0.55
CYP2D6 P10635 1/20 0.55
MEN1 O00255 1/20 0.55
CYP1A2 P05177 1/20 0.55
CYP2C9 P11712 1/20 0.55
KMT2A Q03164 1/20 0.55
ADRB2 P07550 1/20 0.54
GAA P10253 1/20 0.54
BLM P54132 1/20 0.54
TMEM97 Q5BJF2 1/20 0.54
SIGMAR1 Q99720 1/20 0.54
ABCB1 P08183 1/20 0.38

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
SCHEMBL26133050 1.00 ADRB1 (0.55) ADRB1LMNACYP2D6MEN1CYP1A2
SCHEMBL21916491 0.86 ADRB1 (0.46) ADRB1LMNACYP2D6MEN1CYP1A2
SCHEMBL16081355 0.79 ADRB1 (0.55) ADRB1LMNACYP2D6MEN1CYP1A2
SCHEMBL13979172 0.79 ADRB1 (0.67) ADRB1LMNACYP2D6MEN1CYP1A2
SCHEMBL17404733 0.74 ADRB1 (0.61) ADRB1LMNACYP2D6MEN1CYP1A2
SCHEMBL16077979 0.73 ADRB1 (0.51) ADRB1LMNACYP2D6MEN1CYP1A2
SCHEMBL20425360 0.73 ADRB1 (0.51) ADRB1LMNACYP2D6MEN1CYP1A2
SCHEMBL20397508 0.73 ADRB1 (0.46) ADRB1LMNACYP2D6MEN1CYP1A2
SCHEMBL10725084 0.71 ADRB1 (0.69) ADRB1LMNACYP2D6MEN1CYP1A2
SCHEMBL5852951 0.71 ADRB1 (0.69) ADRB1LMNACYP2D6MEN1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12503553-B2 Biodegradable drug-polymer conjugate POLYACTIVA PTY LTD (AU) 2025-12-23 US disclosed
US-20240247106-A1 BIODEGRADABLE DRUG-POLYMER CONJUGATE POLYACTIVA PTY LTD (AU) 2024-07-25 US disclosed
US-11787906-B2 Biodegradable drug-polymer conjugate POLYACTIVA PTY LTD (AU) 2023-10-17 US disclosed
US-11787906-B2 Biodegradable drug-polymer conjugate POLYACTIVA PTY LTD (AU) 2023-10-17 US disclosed
US-11787906-B2 Biodegradable drug-polymer conjugate POLYACTIVA PTY LTD (AU) 2023-10-17 US disclosed
US-20200123322-A1 BIODEGRADABLE DRUG-POLYMER CONJUGATE POLYACTIVA PTY LTD (AU) 2020-04-23 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 (4 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-20240247106-A1 BIODEGRADABLE DRUG-POLYMER CONJUGATE ADRB3, PTGER3, CHRNE ADRB1 15/4885LMNA 477/4885CYP2D6 96/4885
US-20200123322-A1 BIODEGRADABLE DRUG-POLYMER CONJUGATE ADRB3, PTGER3, CHRNE ADRB1 15/4885LMNA 477/4885CYP2D6 96/4885
US-11787906-B2 Biodegradable drug-polymer conjugate ADRB3, PTGER3, CHRM3 ADRB1 13/4885LMNA 444/4885CYP2D6 102/4885
US-12503553-B2 Biodegradable drug-polymer conjugate ADRB3, PTGER3, CHRNE ADRB1 15/4885LMNA 477/4885CYP2D6 96/4885

“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.