SCHEMBL6203970

SCHEMBL6203970

CCOC(=O)/C=C/C1(c2ccccn2)CCCCC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.39
HSD11B1 P28845 1/20 0.39
LMNA P02545 5/20 0.39
KDM4E B2RXH2 2/20 0.38
CASP1 P29466 1/20 0.38
HSD17B10 Q99714 1/20 0.38
GRIN1 Q05586 1/20 0.38
GRIN2A Q12879 1/20 0.38
GRIN2B Q13224 1/20 0.38
MAPT P10636 5/20 0.38
MDM2 Q00987 2/20 0.38
ALDH1A1 P00352 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
MEN1 O00255 1/20 0.37
GAA P10253 1/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
POLB P06746 1/20 0.36
NPC1 O15118 1/20 0.36
NOS2 P35228 1/20 0.36

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
SCHEMBL6203975 1.00 RAB9A (0.39) RAB9AHSD11B1LMNAKDM4ECASP1
SCHEMBL6801335 0.84 HSD11B1 (0.38) HSD11B1LMNAGRIN1GRIN2AGRIN2B
SCHEMBL6801337 0.84 HSD11B1 (0.38) HSD11B1LMNAGRIN1GRIN2AGRIN2B
SCHEMBL8486339 0.83 L3MBTL1 (0.49) LMNAMAPTMDM2ALDH1A1L3MBTL1
SCHEMBL8486337 0.83 L3MBTL1 (0.49) LMNAMAPTMDM2ALDH1A1L3MBTL1
SCHEMBL8484168 0.81 L3MBTL1 (0.50) LMNAMAPTMDM2ALDH1A1L3MBTL1
SCHEMBL8484165 0.81 L3MBTL1 (0.50) LMNAMAPTMDM2ALDH1A1L3MBTL1
SCHEMBL8486156 0.76 L3MBTL1 (0.52) RAB9ALMNAMAPTMDM2ALDH1A1
SCHEMBL8486160 0.76 L3MBTL1 (0.52) RAB9ALMNAMAPTMDM2ALDH1A1
SCHEMBL12000497 0.75 OPRM1 (0.45) HSD11B1LMNAMAPTALDH1A1L3MBTL1

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
EP-1501800-A1 BOMBESIN ANTAGONISTS Warner-Lambert Company LLC (US) 2005-02-02 EP disclosed
US-20040063643-A1 Bombesin antagonists PFIZER INC. 2004-04-01 US disclosed
WO-2003092670-A1 BOMBESIN ANTAGONISTS WARNER-LAMBERT COMPANY LLC (US) 2003-11-13 WO 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-20040063643-A1 Bombesin antagonists BRS3, NPSR1, GNRHR RAB9A 1163/4885HSD11B1 602/4885LMNA 2660/4885

“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.