SCHEMBL11239883

SCHEMBL11239883

N=C(N/N=C/C=C/c1ccccc1)N/N=C/c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.58
HTT P42858 1/20 0.58
NPSR1 Q6W5P4 1/20 0.58
RAB9A P51151 5/20 0.50
NPC1 O15118 4/20 0.50
KMT2A Q03164 3/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
MAPT P10636 3/20 0.50
MEN1 O00255 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
GAA P10253 2/20 0.50
USP2 O75604 1/20 0.50
LMNA P02545 1/20 0.50

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
SCHEMBL11239889 1.00 POLB (0.58) POLBHTTNPSR1RAB9ANPC1
SCHEMBL11239885 1.00 POLB (0.58) POLBHTTNPSR1RAB9ANPC1
SCHEMBL19449710 0.93 POLB (0.65) POLBHTTNPSR1RAB9ANPC1
Hydrochloric Acid SCHEMBL17560921 0.92 POLB (0.63) POLBHTTNPSR1RAB9ANPC1
SCHEMBL7594903 0.86 MEN1 (0.64) RAB9ANPC1KMT2ASMN1; SMN2MEN1
SCHEMBL21937369 0.86 MEN1 (0.64) RAB9ANPC1KMT2ASMN1; SMN2MEN1
SCHEMBL19449623 0.86 MEN1 (0.64) RAB9ANPC1KMT2ASMN1; SMN2MEN1
Hydrochloric Acid SCHEMBL17560801 0.84 MEN1 (0.62) RAB9ANPC1KMT2ASMN1; SMN2MEN1
SCHEMBL11695624 0.81 MEN1 (0.58) RAB9ANPC1KMT2ASMN1; SMN2MEN1
SCHEMBL11695619 0.81 MEN1 (0.58) RAB9ANPC1KMT2ASMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4321274-A Substituted 1-(cinnamylideneamino)-3-benzyli-deneaminoguanidines active against Giardia lamblia and Trichomonas vaginalis MERCK & CO., INC. (US) 1982-03-23 US claimed
US-4321274-A Substituted 1-(cinnamylideneamino)-3-benzyli-deneaminoguanidines active against Giardia lamblia and Trichomonas vaginalis MERCK & CO., INC. (US) 1982-03-23 US disclosed
US-4321274-A Substituted 1-(cinnamylideneamino)-3-benzyli-deneaminoguanidines active against Giardia lamblia and Trichomonas vaginalis MERCK & CO., INC. (US) 1982-03-23 US disclosed