SCHEMBL68944

SCHEMBL68944

NC1CCCN(S(=O)(=O)c2ccc(Cl)cc2)C1

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.64
LMNA P02545 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
KMT2A Q03164 5/20 0.54
MEN1 O00255 4/20 0.54
ALDH1A1 P00352 2/20 0.54
MAPK1 P28482 1/20 0.54
USP2 O75604 1/20 0.53
PKM P14618 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
ATM Q13315 1/20 0.50
MAPT P10636 1/20 0.50
NPSR1 Q6W5P4 1/20 0.49
CNR1 P21554 1/20 0.49
GAA P10253 1/20 0.48

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
SCHEMBL22868370 0.85 MAPT (0.64) POLBLMNAL3MBTL1KMT2AMEN1
SCHEMBL16680003 0.84 LMNA (0.57) LMNAL3MBTL1ALDH1A1MAPK1SMN1; SMN2
SCHEMBL12207333 0.84 LMNA (0.57) LMNAL3MBTL1ALDH1A1MAPK1SMN1; SMN2
SCHEMBL5253065 0.82 MEN1 (0.68) POLBLMNAL3MBTL1KMT2AMEN1
SCHEMBL68943 0.82 POLB (0.64) POLBLMNAL3MBTL1KMT2AMEN1
SCHEMBL5252269 0.82 POLB (0.64) POLBLMNAL3MBTL1KMT2AMEN1
SCHEMBL3712663 0.78 MAPT (0.76) POLBLMNAL3MBTL1KMT2AMEN1
SCHEMBL16252995 0.78 POLB (0.76) POLBLMNAL3MBTL1KMT2AMEN1
SCHEMBL5244762 0.78 MAPT (0.76) POLBLMNAL3MBTL1KMT2AMEN1
SCHEMBL5246057 0.78 MAPT (0.76) POLBLMNAL3MBTL1KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8865732-B2 Heterocyclic compounds and uses thereof NOVARTIS AG (CH) 2014-10-21 US disclosed
US-20130210818-A1 Novel Heterocyclic Compounds and Uses Thereof NOVARTIS AG (CH) 2013-08-15 US disclosed
US-8129394-B2 Heteroaryl-substituted imidazole compounds and uses thereof NOVARTIS AG (CH) 2012-03-06 US disclosed
US-20100003246-A1 Novel heterocyclic compounds and uses therof NOVARTIS AG (CH) 2010-01-07 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-20100003246-A1 Novel heterocyclic compounds and uses therof BRAF, ARAF, KRAS POLB 2484/4885LMNA 2861/4885L3MBTL1 1865/4885
US-20130210818-A1 Novel Heterocyclic Compounds and Uses Thereof BRAF, RAF1, HRAS POLB 2078/4885LMNA 3165/4885L3MBTL1 2266/4885

“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.