SCHEMBL13867482

SCHEMBL13867482

CNCCCCNCCCNC(C)=O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PAOX Q6QHF9 4/20 0.67
KDM4E B2RXH2 2/20 0.62
MAPK1 P28482 1/20 0.62
HIF1A Q16665 1/20 0.62
ADRA1A P35348 1/20 0.50
CA12 O43570 1/20 0.45
CA2 P00918 1/20 0.45
CA3 P07451 1/20 0.45
CA4 P22748 1/20 0.45
CA6 P23280 1/20 0.45
CA5A P35218 1/20 0.45
CA7 P43166 1/20 0.45
CA9 Q16790 1/20 0.45
CA14 Q9ULX7 1/20 0.45
CA5B Q9Y2D0 1/20 0.45
TSHR P16473 1/20 0.41
KDM1A O60341 1/20 0.41
ALDH1A1 P00352 1/20 0.40
S1PR2 O95136 5/20 0.38
S1PR4 O95977 5/20 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
SCHEMBL12070762 0.91 KDM4E (0.75) PAOXKDM4EMAPK1HIF1AADRA1A
SCHEMBL2952645 0.91
SCHEMBL19961838 0.91 PAOX (0.78) PAOXKDM4EMAPK1HIF1AADRA1A
SCHEMBL2128046 0.91 PAOX (0.78) PAOXKDM4EMAPK1HIF1AADRA1A
SCHEMBL22856152 0.89 KDM4E (0.67) PAOXKDM4EMAPK1HIF1AADRA1A
SCHEMBL26279885 0.89 KDM4E (0.60) PAOXKDM4EMAPK1HIF1AADRA1A
SCHEMBL24508761 0.89 KDM4E (0.80) PAOXKDM4EMAPK1HIF1AADRA1A
Hydrochloric Acid SCHEMBL29730791 0.89 PAOX (0.75) PAOXKDM4EMAPK1HIF1AADRA1A
SCHEMBL22197991 0.89 KDM4E (0.80) PAOXKDM4EMAPK1HIF1AADRA1A
SCHEMBL12281920 0.89 KDM4E (0.80) PAOXKDM4EMAPK1HIF1AADRA1A

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
WO-2023220425-A1 BCL-XL/BCL-2 DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2023-11-16 WO disclosed
US-20230295180-A1 PROTEIN DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-09-21 US disclosed
US-20230295180-A1 PROTEIN DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-09-21 US disclosed
WO-2022140472-A1 COMPOUNDS FOR DEGRADING CYCLIN-DEPENDENT KINASE 2 VIA UBIQUITIN PROTEOSOME PATHWAY NIKANG THERAPEUTICS, INC. (US) 2022-06-30 WO disclosed
US-20220119376-A1 TRICYCLIC COMPOUNDS ACTING ON CRBN PROTEINS CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2022-04-21 US disclosed
US-7517913-B2 Polyamine conjugates with acidic retinoids and preparation thereof PAPAIOANNOU DIONYSIOS 2009-04-14 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 (2 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-20220119376-A1 TRICYCLIC COMPOUNDS ACTING ON CRBN PROTEINS CRBN, CSNK2A1, CSNK2A2 PAOX 1799/4885KDM4E 2387/4885MAPK1 859/4885
US-20230295180-A1 PROTEIN DEGRADERS AND USES THEREOF MDM2, CUL1, PSMG3 PAOX 774/4885KDM4E 935/4885MAPK1 3746/4885

“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.