SCHEMBL7972207

SCHEMBL7972207

NCCNC(=O)Cc1c[nH]c2ccccc12

nearest known ligand 0.71

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.67
ALDH1A1 P00352 3/20 0.65
SMN1; SMN2 Q16637 2/20 0.61
GAA P10253 2/20 0.61
AANAT Q16613 1/20 0.59
MAPT P10636 3/20 0.58
PKM P14618 2/20 0.58
KMT2A Q03164 4/20 0.58
MEN1 O00255 3/20 0.58
KDM4E B2RXH2 1/20 0.56
HPGD P15428 1/20 0.56
HTT P42858 1/20 0.56
MC1R Q01726 1/20 0.56
CYP1A2 P05177 1/20 0.55
TSHR P16473 1/20 0.55
CYP2C19 P33261 1/20 0.55
BLM P54132 1/20 0.55

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
SCHEMBL7976825 0.91 SMN1; SMN2 (0.71) LMNAALDH1A1SMN1; SMN2GAAAANAT
SCHEMBL9797755 0.91 LMNA (0.63) LMNAALDH1A1SMN1; SMN2GAAAANAT
SCHEMBL7972279 0.87 SMN1; SMN2 (0.66) LMNAALDH1A1SMN1; SMN2GAAAANAT
SCHEMBL1849735 0.87 LMNA (0.65) LMNAALDH1A1SMN1; SMN2GAAAANAT
SCHEMBL10069200 0.87 AANAT (0.77) LMNAALDH1A1AANATPKMKMT2A
SCHEMBL10339735 0.86 CA12 (0.65) LMNAALDH1A1SMN1; SMN2GAAKMT2A
SCHEMBL29376803 0.86 CA12 (0.65) LMNAALDH1A1SMN1; SMN2GAAKMT2A
SCHEMBL4101920 0.86 CA12 (0.65) LMNAALDH1A1SMN1; SMN2GAAKMT2A
SCHEMBL31389231 0.86 CA12 (0.65) LMNAALDH1A1SMN1; SMN2GAAKMT2A
SCHEMBL10272692 0.86 MTNR1A (0.64) LMNAALDH1A1SMN1; SMN2GAAAANAT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2001055109-A1 AROMATIC AMIDES ACTING ON MELANOCORTIN RECEPTORS MELACURE THERAPEUTICS AB (SE) 2001-08-02 WO claimed
WO-2001055109-A1 AROMATIC AMIDES ACTING ON MELANOCORTIN RECEPTORS MELACURE THERAPEUTICS AB (SE) 2001-08-02 WO disclosed
EP-0035474-B1 AMIDINES, PROCESS FOR THEIR PRODUCTION, PHARMACEUTICAL PREPARATIONS CONTAINING THEM AND THEIR USE CIBA-GEIGY AG (CH) 1985-06-05 EP disclosed
US-4444768-A ICE CREAM CONE WRAPPER CIBA-GEIGY CORPORATION (US) 1984-04-24 US disclosed
EP-0035474-A1 Amidines, process for their production, pharmaceutical preparations containing them and their use CIBA-GEIGY AG (CH) 1981-09-09 EP disclosed