SCHEMBL21853676

SCHEMBL21853676

C=c1cnc(C)c(O)c1=C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ HPGD P15428 2/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ PDXK O00764 1/20 0.40
▸ LMNA P02545 2/20 0.37
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ AOX1 Q06278 1/20 0.36
▸ TRIM24 O15164 1/20 0.35
▸ TRIM33 Q9UPN9 1/20 0.35
▸ VRK1 Q99986 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ CYP2D6 P10635 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ P2RX3 P56373 1/20 0.33
▸ ESR1 P03372 1/20 0.30
▸ PTGS1 P23219 1/20 0.30
▸ ACP1 P24666 1/20 0.30
▸ PDE4A P27815 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
SCHEMBL9656217 0.68 KDM4E (0.42) KDM4EALDH1A1HPGDHSD17B10PDXK
SCHEMBL9656230 0.67 KDM4E (0.45) KDM4EALDH1A1HPGDHSD17B10PDXK
SCHEMBL3679226 0.65 KDM4E (0.43) KDM4EALDH1A1HPGDHSD17B10PDXK
SCHEMBL2260982 0.65 KDM4E (0.43) KDM4EALDH1A1HPGDHSD17B10PDXK
SCHEMBL31184201 0.65 KDM4E (0.43) KDM4EALDH1A1HPGDHSD17B10PDXK
Methane SCHEMBL6846367 0.63 KDM4E (0.42) KDM4EALDH1A1HPGDHSD17B10PDXK
SCHEMBL15322103 0.63 KDM4E (0.42) KDM4EALDH1A1HPGDHSD17B10PDXK
SCHEMBL26287526 0.63 KDM4E (0.42) KDM4EALDH1A1HPGDHSD17B10PDXK
SCHEMBL11450620 0.62 KDM4E (0.50) KDM4EALDH1A1HPGDHSD17B10PDXK
SCHEMBL11458019 0.62 KDM4E (0.50) KDM4EALDH1A1HPGDHSD17B10PDXK

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
CN-118340907-A Polymer conjugates comprising bioactive agents 波利艾克蒂瓦有限公司 2024-07-16 — — CN disclosed
US-11787906-B2 Biodegradable drug-polymer conjugate POLYACTIVA PTY LTD (AU) 2023-10-17 — — US disclosed
US-20220401455-A1 BIODEGRADABLE DRUG-POLYMER CONJUGATE POLYACTIVA PTY LTD (AU) 2022-12-22 — — US disclosed
WO-2021051149-A1 BIODEGRADABLE DRUG-POLYMER CONJUGATE POLYACTIVA PTY LTD (AU) 2021-03-25 — — WO disclosed
US-20200123322-A1 BIODEGRADABLE DRUG-POLYMER CONJUGATE POLYACTIVA PTY LTD (AU) 2020-04-23 — — US disclosed
CN-110662561-A Biodegradable drug-polymer conjugates 波利艾克蒂瓦有限公司 2020-01-07 — — CN 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 (3 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-20200123322-A1 BIODEGRADABLE DRUG-POLYMER CONJUGATE ADRB3, PTGER3, CHRNE KDM4E 1790/4885ALDH1A1 1039/4885HPGD 881/4885
US-20220401455-A1 BIODEGRADABLE DRUG-POLYMER CONJUGATE PTGER1, PTGDR, F12 KDM4E 2195/4885ALDH1A1 688/4885HPGD 422/4885
US-11787906-B2 Biodegradable drug-polymer conjugate ADRB3, PTGER3, CHRM3 KDM4E 1912/4885ALDH1A1 907/4885HPGD 911/4885

“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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