SCHEMBL24974012

SCHEMBL24974012

CC(C)CC(=O)N1CC(C)C1

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.59
POLB P06746 4/20 0.47
NPSR1 Q6W5P4 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
CHRNB2 P17787 1/20 0.39
CHRNA4 P43681 1/20 0.39
ATM Q13315 1/20 0.39
ALDH1A1 P00352 3/20 0.39
LMNA P02545 1/20 0.39
PTPN1 P18031 1/20 0.39
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
GAA P10253 1/20 0.38
KDM4E B2RXH2 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
MDM2 Q00987 1/20 0.37

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
SCHEMBL15131744 0.92 SMN1; SMN2 (0.55) SMN1; SMN2POLBNPSR1L3MBTL1ALDH1A1
SCHEMBL19431618 0.84 SMN1; SMN2 (0.52) SMN1; SMN2POLBNPSR1L3MBTL1ALDH1A1
SCHEMBL18731194 0.84 SMN1; SMN2 (0.52) SMN1; SMN2POLBNPSR1L3MBTL1ALDH1A1
SCHEMBL15490020 0.83 SMN1; SMN2 (0.53) SMN1; SMN2POLBNPSR1L3MBTL1ATM
SCHEMBL17190676 0.83 SMN1; SMN2 (0.53) SMN1; SMN2POLBNPSR1L3MBTL1CHRNB2
SCHEMBL19104799 0.83 SMN1; SMN2 (0.53) SMN1; SMN2POLBNPSR1L3MBTL1ATM
SCHEMBL12197935 0.82 SMN1; SMN2 (0.53) SMN1; SMN2POLBNPSR1L3MBTL1CHRNB2
SCHEMBL12764368 0.82 SMN1; SMN2 (0.53) SMN1; SMN2POLBNPSR1L3MBTL1ALDH1A1
SCHEMBL13401071 0.82 SMN1; SMN2 (0.53) SMN1; SMN2POLBNPSR1L3MBTL1CHRNB2
SCHEMBL17190672 0.82 SMN1; SMN2 (0.53) SMN1; SMN2POLBNPSR1L3MBTL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11572364-B2 Pteridinone compounds and uses thereof VERTEX PHARMACEUTICALS INCORPORATED (US) 2023-02-07 US disclosed
US-20170110671-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2017-04-20 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-11572364-B2 Pteridinone compounds and uses thereof DPYD, PKD1, TYMP SMN1; SMN2 1711/4885POLB 300/4885NPSR1 2323/4885
US-20170110671-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME LOXL1, ELOVL1, LPO SMN1; SMN2 1883/4885POLB 2423/4885NPSR1 4537/4885

“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.