SCHEMBL6214919

SCHEMBL6214919

N#Cc1ccccc1NC(=O)Cc1cccnc1C1=CCNCC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MEN1 O00255 2/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
P2RX7 Q99572 1/20 0.40
GAA P10253 1/20 0.40
TSHR P16473 1/20 0.39
LMNA P02545 2/20 0.38
MAPK1 P28482 2/20 0.38
ALDH1A1 P00352 1/20 0.38
PRMT5 O14744 1/20 0.38
WDR77 Q9BQA1 1/20 0.38
HDAC1 Q13547 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
MAPK8 P45983 1/20 0.37
MAPK9 P45984 1/20 0.37
MAPK10 P53779 1/20 0.37
ACHE P22303 1/20 0.37
BACE1 P56817 1/20 0.37

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
SCHEMBL7248437 0.83 MAPK1 (0.47) KMT2ASMN1; SMN2MEN1RAB9AGAA
SCHEMBL6212381 0.82 MEN1 (0.46) KMT2AMEN1RAB9AP2RX7GAA
SCHEMBL6215690 0.79 WNT3A (0.47) KMT2ASMN1; SMN2MEN1NPC1RAB9A
SCHEMBL6212034 0.79 CYP1A2 (0.41) KMT2AMEN1RAB9AGAAALDH1A1
SCHEMBL6214400 0.79 WNT3A (0.40) KMT2ASMN1; SMN2MEN1GAATSHR
SCHEMBL6260425 0.78 TP53 (0.39) KMT2ASMN1; SMN2MEN1NPC1RAB9A
SCHEMBL6209953 0.77 WNT3A (0.42) LMNAALDH1A1
SCHEMBL6216012 0.77 DRD4 (0.41) KMT2AMEN1NPC1RAB9AP2RX7
SCHEMBL5917545 0.76 SIGMAR1 (0.44)
SCHEMBL6212859 0.76 DRD2 (0.45) KMT2AMEN1NPC1RAB9AALDH1A1

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
EP-1509213-A2 ACETAMIDES AND BENZAMIDES THAT ARE USEFUL IN TREATING SEXUAL DYSFUNCTION Abbott Laboratories (US) 2005-03-02 EP disclosed
WO-2003099266-A2 ACETAMIDES AND BENZAMIDES THAT ARE USEFUL IN TREATING SEXUAL DYSFUNCTION ABBOTT LABORATORIES (US) 2003-12-04 WO disclosed