SCHEMBL7973953

SCHEMBL7973953

O=C(Cc1c[nH]c2ccccc12)NCCCNCCNC(=O)Cc1c[nH]c2ccccc12

nearest known ligand 0.92

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.60
SMN1; SMN2 Q16637 1/20 0.60
LMNA P02545 2/20 0.60
ALDH1A1 P00352 1/20 0.58
MEN1 O00255 1/20 0.57
KMT2A Q03164 1/20 0.57
AANAT Q16613 1/20 0.55
MAPT P10636 1/20 0.55
PKM P14618 1/20 0.55
MTNR1A P48039 1/20 0.54
SSTR3 P32745 1/20 0.54
HTT P42858 1/20 0.53

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
SCHEMBL7973858 0.97 LMNA (0.62) GAASMN1; SMN2LMNAALDH1A1MEN1
SCHEMBL7970603 0.96 LMNA (0.61) GAASMN1; SMN2LMNAALDH1A1MEN1
Hydrochloric Acid SCHEMBL7974140 0.95 LMNA (0.60) GAASMN1; SMN2LMNAALDH1A1MEN1
SCHEMBL7972279 0.95 SMN1; SMN2 (0.66) GAASMN1; SMN2LMNAALDH1A1MEN1
SCHEMBL7974076 0.93 LMNA (0.61) GAASMN1; SMN2LMNAALDH1A1MEN1
SCHEMBL7976825 0.90 SMN1; SMN2 (0.71) GAASMN1; SMN2LMNAALDH1A1MEN1
SCHEMBL4101920 0.90 CA12 (0.65) GAASMN1; SMN2LMNAALDH1A1MEN1
SCHEMBL31389231 0.90 CA12 (0.65) GAASMN1; SMN2LMNAALDH1A1MEN1
SCHEMBL10339735 0.90 CA12 (0.65) GAASMN1; SMN2LMNAALDH1A1MEN1
SCHEMBL29376803 0.90 CA12 (0.65) GAASMN1; SMN2LMNAALDH1A1MEN1

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 2 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