SCHEMBL8280845

SCHEMBL8280845

CCN1CC[C@H](NC(C)=O)C1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.47
CA2 P00918 2/20 0.47
CA12 O43570 1/20 0.47
CA9 Q16790 1/20 0.47
LTA4H P09960 3/20 0.46
EPHX1 P07099 1/20 0.44
EPHX2 P34913 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
ATM Q13315 1/20 0.43
RECQL P46063 1/20 0.42
ALDH1A1 P00352 1/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 1/20 0.41
GAA P10253 1/20 0.41
PDCD1LG2 Q9BQ51 3/20 0.40
CD274 Q9NZQ7 3/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
MAPK1 P28482 1/20 0.39

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
SCHEMBL8280869 1.00 CA1 (0.47) CA1CA2CA12CA9LTA4H
SCHEMBL8280843 1.00 CA1 (0.47) CA1CA2CA12CA9LTA4H
SCHEMBL17267045 0.89 CA1 (0.56) CA1CA2CA12CA9ATM
SCHEMBL8280861 0.89 CA1 (0.56) CA1CA2CA12CA9ATM
SCHEMBL17985672 0.89 CA1 (0.56) CA1CA2CA12CA9ATM
SCHEMBL7376937 0.89 HRH3 (0.43) CA1CA2CA12CA9ATM
SCHEMBL12337290 0.89 EPHX1 (0.54) CA1CA2CA12CA9LTA4H
SCHEMBL13102170 0.86 LTA4H (0.50) CA1CA2CA12CA9LTA4H
SCHEMBL172561 0.86 LTA4H (0.50) CA1CA2CA12CA9LTA4H
SCHEMBL6980363 0.86 LTA4H (0.50) CA1CA2CA12CA9LTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021101919-A1 COMPOUNDS USEFUL AS INHIBITORS OF HELIOS PROTEIN BRISTOL-MYERS SQUIBB COMPANY (US) 2021-05-27 WO disclosed
WO-2017103670-A1 1H-IMIDAZO[4,5-B]PYRIDINYL AND 2-OXO-2,3-DIHYDRO-1H-IMIDAZO[4,5-B]PYRIDINYL HETEROCYCLIC BET BROMODOMAIN INHIBITORS ZENITH EPIGENETICS LID. (CA) 2017-06-22 WO disclosed
US-8207179-B2 Substituted indolines as tyrosine kinase inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-06-26 US disclosed
WO-2010115264-A1 INHIBITORS OF HIV REPLICATION BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-10-14 WO disclosed
US-20100222331-A1 NEW COMPOUNDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-09-02 US disclosed
US-7485641-B2 Substituted 3-amino-pyrrolidino-4-lactams PFIZER, INC. (US) 2009-02-03 US disclosed
US-20070299076-A1 Substituted 3-Amino-Pyrrolidino-4-Lactams PFIZER INC 2007-12-27 US disclosed
WO-2005080389-A1 INDAZOLE-CARBOXAMIDE COMPOUNDS AS 5-HT4 RECEPTOR AGONISTS THERAVANCE, INC. (US) 2005-09-01 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 (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-20070299076-A1 Substituted 3-Amino-Pyrrolidino-4-Lactams PRMT1, PRMT7, PRMT3 CA1 3075/4885CA2 3033/4885CA12 2978/4885
US-20100222331-A1 NEW COMPOUNDS CCNA1, CCNY, MKI67 CA1 4059/4885CA2 2737/4885CA12 3238/4885

“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.