SCHEMBL11514545

SCHEMBL11514545

CCC(Oc1ccc(C(C)(C)CC)cc1C(C)(C)CC)C(=O)Nc1cccc([NH])c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.43
MAPK1 P28482 5/20 0.43
NPSR1 Q6W5P4 5/20 0.43
MEN1 O00255 5/20 0.43
KMT2A Q03164 5/20 0.43
ALDH1A1 P00352 2/20 0.43
APOBEC3A P31941 1/20 0.39
APOBEC3G Q9HC16 1/20 0.39
MAPT P10636 5/20 0.38
HTT P42858 3/20 0.38
UBE2N P61088 2/20 0.38
MITF O75030 1/20 0.38
LMNA P02545 1/20 0.36
GLA P06280 1/20 0.36
SIRT2 Q8IXJ6 2/20 0.35
RAD52 P43351 2/20 0.35
STAT3 P40763 1/20 0.35
RCE1 Q9Y256 1/20 0.35
APAF1 O14727 1/20 0.35
HSP90AA1 P07900 1/20 0.35

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
SCHEMBL8616536 0.89 KMT2A (0.42) SMN1; SMN2MAPK1NPSR1MEN1KMT2A
SCHEMBL14564633 0.89 KMT2A (0.46) SMN1; SMN2MAPK1NPSR1MEN1KMT2A
SCHEMBL11514547 0.88 MAPK1 (0.43) SMN1; SMN2MAPK1NPSR1MEN1KMT2A
SCHEMBL12548790 0.88 ALDH1A1 (0.43) SMN1; SMN2MAPK1NPSR1MEN1KMT2A
SCHEMBL10907411 0.88 SMN1; SMN2 (0.43) SMN1; SMN2MAPK1NPSR1MEN1KMT2A
SCHEMBL9814168 0.87 ALDH1A1 (0.47) SMN1; SMN2MAPK1NPSR1MEN1KMT2A
SCHEMBL10470820 0.86 SMN1; SMN2 (0.41) SMN1; SMN2MAPK1NPSR1MEN1KMT2A
SCHEMBL8616540 0.86 PARP1 (0.49) SMN1; SMN2MAPK1NPSR1MEN1KMT2A
SCHEMBL14462088 0.86 SMN1; SMN2 (0.41) SMN1; SMN2MAPK1NPSR1MEN1KMT2A
SCHEMBL8868022 0.85 MAPT (0.45) SMN1; SMN2MAPK1NPSR1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4171975-A MAGENTA COUPLER AND AN AMIDE KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) 1979-10-23 US disclosed