SCHEMBL3085802

SCHEMBL3085802

Cc1cc(NC(=O)CCN)n(C)n1

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.57
HTT P42858 3/20 0.48
KDM4E B2RXH2 2/20 0.48
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
KDM1A O60341 2/20 0.45
ALDH1A1 P00352 5/20 0.43
ATM Q13315 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
NTRK1 P04629 1/20 0.41
POLB P06746 1/20 0.41
TSHR P16473 1/20 0.40
PKM P14618 1/20 0.40

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
SCHEMBL9164082 0.85 SMN1; SMN2 (0.58) SMN1; SMN2HTTKDM4EMEN1KMT2A
SCHEMBL6361845 0.81 SMN1; SMN2 (0.62) SMN1; SMN2HTTKDM4EMEN1KMT2A
SCHEMBL11200266 0.81 SMN1; SMN2 (0.62) SMN1; SMN2HTTKDM4EMEN1KMT2A
SCHEMBL7932259 0.80 SMN1; SMN2 (0.60) SMN1; SMN2HTTKDM4EMEN1KMT2A
SCHEMBL4009660 0.80 SMN1; SMN2 (0.60) SMN1; SMN2HTTKDM4EMEN1KMT2A
SCHEMBL29763579 0.78 SMN1; SMN2 (0.66) SMN1; SMN2HTTKDM4EMEN1KMT2A
SCHEMBL12630088 0.77 SMN1; SMN2 (0.57) SMN1; SMN2HTTKDM4EMEN1KMT2A
SCHEMBL3774089 0.77 SMN1; SMN2 (0.70) SMN1; SMN2HTTKDM4EMEN1KMT2A
SCHEMBL14517820 0.76 LMNA (0.68) SMN1; SMN2KDM4EMEN1KMT2AALDH1A1
SCHEMBL48934 0.75 SMN1; SMN2 (0.68) SMN1; SMN2HTTKDM4EMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7799810-B2 Organic compounds NOVARTIS AG (CH) 2010-09-21 US disclosed
US-7799810-B2 Organic compounds NOVARTIS AG (CH) 2010-09-21 US disclosed
US-7799810-B2 Organic compounds NOVARTIS AG (CH) 2010-09-21 US disclosed
US-20100120865-A1 Organic compounds NOVARTIS AG (CH) 2010-05-13 US disclosed
US-20100120865-A1 Organic compounds NOVARTIS AG (CH) 2010-05-13 US disclosed
US-20100120865-A1 Organic compounds NOVARTIS AG (CH) 2010-05-13 US disclosed
EP-2035413-A2 THIAZOLYL UREA DERIVATIVES AS PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS Novartis AG (CH) 2009-03-18 EP disclosed
WO-2008000421-A2 THIAZOLYL UREA DERIVATIVES AS PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS NOVARTIS AG (CH) 2008-01-03 WO disclosed
WO-2008000421-A2 THIAZOLYL UREA DERIVATIVES AS PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS NOVARTIS AG (CH) 2008-01-03 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-20100120865-A1 Organic compounds PIK3C3, PIK3R3, PIK3R4 SMN1; SMN2 4326/4885HTT 4504/4885KDM4E 3125/4885

“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.