SCHEMBL8515531

SCHEMBL8515531

CCN(CC)CCOc1cc(CN)nc(-c2ccccn2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LYN P07948 1/20 0.42
SRC P12931 1/20 0.42
HTT P42858 3/20 0.41
CYP2D6 P10635 3/20 0.41
CYP1A2 P05177 2/20 0.41
CYP2C9 P11712 2/20 0.41
CYP2C19 P33261 2/20 0.41
LTA4H P09960 1/20 0.41
ESR1 P03372 3/20 0.40
KDM4E B2RXH2 3/20 0.40
TSHR P16473 1/20 0.40
KMT2A Q03164 4/20 0.39
MAPT P10636 3/20 0.39
MEN1 O00255 2/20 0.39
APAF1 O14727 1/20 0.39
NSD2 O96028 1/20 0.39
LMNA P02545 1/20 0.39
TP53 P04637 1/20 0.39
POLB P06746 1/20 0.39
GAA P10253 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
SCHEMBL9290571 0.85 CYP2D6 (0.43) LYNSRCHTTCYP2D6CYP1A2
SCHEMBL8515940 0.81 KDM4E (0.48) LYNSRCHTTCYP2D6CYP1A2
SCHEMBL8515937 0.80 ESR1 (0.44) LYNSRCHTTCYP2D6CYP1A2
SCHEMBL8513636 0.79 HSP90AA1 (0.54) HTTCYP1A2KDM4EMAPTLMNA
SCHEMBL9290651 0.76 NPY5R (0.44) LYNSRCESR1KDM4ETSHR
SCHEMBL8514809 0.76 SQLE (0.42) LYNSRCHTTKDM4ETSHR
SCHEMBL9290572 0.75 KDM4E (0.43) LYNSRCHTTKDM4ETSHR
SCHEMBL9290602 0.75 HTT (0.36) LYNSRCHTTCYP2D6CYP1A2
SCHEMBL9290644 0.74 HPGD (0.42) LYNSRCHTTCYP1A2CYP2C9
SCHEMBL8617860 0.73 CCR1 (0.51) HTTCYP2D6CYP1A2CYP2C9CYP2C19

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
EP-2643299-B1 BIPYRIDINE SULFONAMIDE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES OR CONDITIONS NOSCIRA SA (ES) 2016-06-22 EP disclosed
EP-2643299-B1 BIPYRIDINE SULFONAMIDE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES OR CONDITIONS NOSCIRA SA (ES) 2016-06-22 EP disclosed
US-9284296-B2 Bipyridine sulfonamide derivatives for the treatment of neurodegenerative diseases or conditions AUBERGINE PHARMACEUTICALS LLC (US) 2016-03-15 US disclosed
US-9284296-B2 Bipyridine sulfonamide derivatives for the treatment of neurodegenerative diseases or conditions AUBERGINE PHARMACEUTICALS LLC (US) 2016-03-15 US disclosed
US-20140005195-A1 BIPYRIDINE SULFONAMIDE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES OR CONDITIONS NOSCIRA, S.A. (ES) 2014-01-02 US disclosed
EP-2643299-A1 BIPYRIDINE SULFONAMIDE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES OR CONDITIONS Noscira, S.A. (ES) 2013-10-02 EP disclosed
WO-2012069428-A1 BIPYRIDINE SULFONAMIDE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES OR CONDITIONS NOSCIRA, S.A. (ES) 2012-05-31 WO disclosed
WO-2012069428-A1 BIPYRIDINE SULFONAMIDE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES OR CONDITIONS NOSCIRA, S.A. (ES) 2012-05-31 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-20140005195-A1 BIPYRIDINE SULFONAMIDE DERIVATIVES FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES OR CONDITIONS SNCA, PSEN2, PSEN1 LYN 3803/4885SRC 3241/4885HTT 17/4885

“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.