SCHEMBL11236812

SCHEMBL11236812

N#Cc1ccc(C=NNC(=N)NN=Cc2ccc(Br)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.53
ALDH1A1 P00352 4/20 0.53
GAA P10253 3/20 0.53
KDM4E B2RXH2 2/20 0.53
SMN1; SMN2 Q16637 5/20 0.51
HTT P42858 1/20 0.48
MEN1 O00255 7/20 0.47
KMT2A Q03164 7/20 0.47
MAPT P10636 5/20 0.47
KCNH2 Q12809 1/20 0.47
RAB9A P51151 4/20 0.46
NPC1 O15118 4/20 0.44
CYP1A2 P05177 2/20 0.44
TDP1 Q9NUW8 2/20 0.44
POLB P06746 2/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
RECQL P46063 1/20 0.43

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
SCHEMBL11236808 1.00 LMNA (0.53) LMNAALDH1A1GAAKDM4ESMN1; SMN2
Bromide SCHEMBL11770679 0.98 LMNA (0.51) LMNAALDH1A1GAAKDM4ESMN1; SMN2
Bromide SCHEMBL11781114 0.98 LMNA (0.51) LMNAALDH1A1GAAKDM4ESMN1; SMN2
SCHEMBL11230219 0.92 ALDH1A1 (0.61) LMNAALDH1A1GAAKDM4ESMN1; SMN2
SCHEMBL11230215 0.92 ALDH1A1 (0.61) LMNAALDH1A1GAAKDM4ESMN1; SMN2
Hydrochloric Acid SCHEMBL11771736 0.91 KDM4E (0.59) LMNAALDH1A1GAAKDM4ESMN1; SMN2
Hydrochloric Acid SCHEMBL11771741 0.91 KDM4E (0.59) LMNAALDH1A1GAAKDM4ESMN1; SMN2
SCHEMBL13673595 0.88 ALDH1A1 (0.56) LMNAALDH1A1GAAKDM4ESMN1; SMN2
SCHEMBL13673596 0.88 ALDH1A1 (0.56) LMNAALDH1A1GAAKDM4ESMN1; SMN2
SCHEMBL13380939 0.87 MEN1 (0.57) LMNAALDH1A1GAASMN1; SMN2HTT

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
US-4310541-A WITH A BIS(BENZYLIDENEAMINO)GUANIDINE MERCK & CO., INC. (US) 1982-01-12 US claimed
US-4310541-A WITH A BIS(BENZYLIDENEAMINO)GUANIDINE MERCK & CO., INC. (US) 1982-01-12 US disclosed