SCHEMBL18624174

SCHEMBL18624174

CC(C)CON1C(=O)CCC1=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX12 P18054 1/20 0.38
▸ PIK3CD O00329 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ LMNA P02545 2/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ NFKB1 P19838 1/20 0.34
▸ PTGS1 P23219 1/20 0.34
▸ APEX1 P27695 1/20 0.34
▸ THPO P40225 1/20 0.34
▸ PMP22 Q01453 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ SMN1; SMN2 Q16637 3/20 0.33
▸ CTSV O60911 1/20 0.33
▸ CTSL P07711 1/20 0.33
▸ CTSB P07858 1/20 0.33
▸ CTSS P25774 1/20 0.33

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
SCHEMBL17701589 0.84 ALOX12 (0.34) ALOX12PIK3CDKDM4EPOLBLMNA
SCHEMBL22757181 0.84 ALOX12 (0.34) ALOX12PIK3CDKDM4EPOLBLMNA
SCHEMBL22970122 0.81 ALOX12 (0.35) ALOX12KDM4EPOLBLMNASMN1; SMN2
SCHEMBL20420073 0.81 ALOX12 (0.33) ALOX12PIK3CDKDM4EPOLBLMNA
SCHEMBL18532376 0.79 ALOX12 (0.34) ALOX12KDM4EPOLBLMNASMN1; SMN2
SCHEMBL21786204 0.78 ALOX12 (0.36) ALOX12KDM4EPOLBLMNASMN1; SMN2
SCHEMBL24114378 0.78 ALOX12 (0.33) ALOX12KDM4EPOLBLMNATSHR
SCHEMBL21118020 0.78 ALOX12 (0.33) ALOX12KDM4EPOLBLMNAMEN1
SCHEMBL20725208 0.75 ALOX12 (0.32) ALOX12KDM4EPOLBKMT2A
SCHEMBL3859731 0.75 KDM4E (0.35) ALOX12KDM4EPOLBLMNAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020043747-A1 TRACELESS REDUCTIVELY CLEAVABLE LINKER MOLECULES FOR PEPTIDE PURIFICATION Belyntic GmbH (DE) 2020-03-05 — — WO disclosed
US-9795685-B2 Haptens of aripiprazole JANSSEN PHARMACEUTICA NV (BE) 2017-10-24 — — US disclosed
US-20170072061-A1 HAPTENS OF ARIPIPRAZOLE JANSSEN PHARMACEUTICA NV (BE) 2017-03-16 — — 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-20170072061-A1 HAPTENS OF ARIPIPRAZOLE HRH2, HRH4, CYP2D6 ALOX12 1962/4885PIK3CD 2479/4885KDM4E 2540/4885

“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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