SCHEMBL11064443

SCHEMBL11064443

CCC(=O)NC1=NN(c2ccccc2)CC1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.63
KMT2A Q03164 1/20 0.63
MAPT P10636 3/20 0.59
ALDH1A1 P00352 3/20 0.59
KDM4E B2RXH2 2/20 0.59
MAPK1 P28482 2/20 0.59
GAA P10253 2/20 0.59
ABL1 P00519 7/20 0.48
RAB9A P51151 4/20 0.44
NPC1 O15118 3/20 0.44
GLA P06280 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
HPGD P15428 2/20 0.43
TP53 P04637 1/20 0.43
HSD17B10 Q99714 1/20 0.43
LMNA P02545 1/20 0.42
MAOB P27338 2/20 0.42
ADORA3 P0DMS8 1/20 0.41

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
SCHEMBL10655819 0.85 ABL1 (0.55) MEN1KMT2AMAPTALDH1A1KDM4E
SCHEMBL11059744 0.85 MEN1 (0.66) MEN1KMT2AMAPTALDH1A1KDM4E
SCHEMBL10838273 0.81 ALOX5 (0.55) MEN1KMT2AMAPTALDH1A1KDM4E
SCHEMBL1033102 0.80 MAPT (0.47) MEN1KMT2AMAPTALDH1A1KDM4E
SCHEMBL10838815 0.78 MEN1 (0.50) MEN1KMT2AMAPTALDH1A1KDM4E
SCHEMBL11054645 0.78 MEN1 (0.61) MEN1KMT2AMAPTALDH1A1KDM4E
SCHEMBL10418480 0.75 KMT2A (0.54) MEN1KMT2AMAPTALDH1A1KDM4E
Hydrochloric Acid SCHEMBL11110453 0.74 MEN1 (0.52) MEN1KMT2AMAPTALDH1A1KDM4E
SCHEMBL11863473 0.74 MEN1 (0.72) MEN1KMT2AMAPTALDH1A1KDM4E
SCHEMBL11057349 0.73 MEN1 (0.54) MEN1KMT2AMAPTALDH1A1KDM4E

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-4447442-A ANTIINFLAMMATORY, ANTIARTHRITIC, ANTIHISTAMINE, ANTIALLERGENS, ANALGESICS, BACTERICIDES, AND FUNGICIDES AMERICAN CYANAMID COMPANY (US) 1984-05-08 US disclosed
EP-0070376-A1 Heterocyclic substituted-amino-pyrazolines AMERICAN CYANAMID COMPANY (US) 1983-01-26 EP disclosed
US-4348527-A ANALGESICS, BACTERICIDES, FUNGICIDES AMERICAN CYANAMID COMPANY (US) 1982-09-07 US disclosed