SCHEMBL11514547

SCHEMBL11514547

CCC(Oc1ccc(C(C)(C)CC)cc1C(C)(C)CC)C(=O)Nc1cccc(N)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 5/20 0.43
NPSR1 Q6W5P4 5/20 0.43
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
SMN1; SMN2 Q16637 4/20 0.43
ALDH1A1 P00352 2/20 0.43
APOBEC3A P31941 1/20 0.39
APOBEC3G Q9HC16 1/20 0.39
PTGS1 P23219 1/20 0.38
MAPT P10636 4/20 0.38
HTT P42858 3/20 0.38
UBE2N P61088 2/20 0.38
MITF O75030 1/20 0.38
DDX3X O00571 2/20 0.38
PARP1 P09874 1/20 0.37
PARP10 Q53GL7 1/20 0.37
LMNA P02545 1/20 0.36
GLA P06280 1/20 0.36
SIRT2 Q8IXJ6 2/20 0.35
RAD52 P43351 2/20 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
SCHEMBL10907411 0.90 SMN1; SMN2 (0.43) MAPK1NPSR1MEN1KMT2ASMN1; SMN2
SCHEMBL14564633 0.89 KMT2A (0.46) MAPK1NPSR1MEN1KMT2ASMN1; SMN2
SCHEMBL14462088 0.88 SMN1; SMN2 (0.41) MAPK1NPSR1MEN1KMT2ASMN1; SMN2
SCHEMBL8616540 0.88 PARP1 (0.49) MAPK1NPSR1MEN1KMT2ASMN1; SMN2
SCHEMBL11514545 0.88 SMN1; SMN2 (0.43) MAPK1NPSR1MEN1KMT2ASMN1; SMN2
SCHEMBL12548790 0.88 ALDH1A1 (0.43) MAPK1NPSR1MEN1KMT2ASMN1; SMN2
SCHEMBL8616536 0.87 KMT2A (0.42) MAPK1NPSR1MEN1KMT2ASMN1; SMN2
SCHEMBL9814168 0.87 ALDH1A1 (0.47) MAPK1NPSR1MEN1KMT2ASMN1; SMN2
SCHEMBL10470820 0.86 SMN1; SMN2 (0.41) MAPK1NPSR1MEN1KMT2ASMN1; SMN2
SCHEMBL7044703 0.86 SMN1; SMN2 (0.39) MAPK1NPSR1MEN1KMT2ASMN1; SMN2

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