SCHEMBL8868022

SCHEMBL8868022

CCC(Oc1ccc(C(C)(C)CC)cc1C(C)(C)CC)C(=O)Nc1cccc(NC(=O)C(Cl)C(=O)C(C)(C)C)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.45
HSP90AA1 P07900 2/20 0.45
GPR55 Q9Y2T6 1/20 0.45
SMN1; SMN2 Q16637 6/20 0.41
MEN1 O00255 6/20 0.41
KMT2A Q03164 6/20 0.41
MAPK1 P28482 5/20 0.41
NPSR1 Q6W5P4 5/20 0.41
ALDH1A1 P00352 2/20 0.41
APOBEC3A P31941 1/20 0.38
APOBEC3G Q9HC16 1/20 0.38
TP53 P04637 1/20 0.37
HTT P42858 3/20 0.36
UBE2N P61088 2/20 0.36
MITF O75030 1/20 0.36
ACACB O00763 1/20 0.35
LMNA P02545 3/20 0.34
GLA P06280 1/20 0.34
SIRT2 Q8IXJ6 2/20 0.34
RAD52 P43351 2/20 0.34

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
SCHEMBL11817386 0.88 MEN1 (0.41) MAPTHSP90AA1GPR55SMN1; SMN2MEN1
SCHEMBL10907411 0.87 SMN1; SMN2 (0.43) MAPTHSP90AA1SMN1; SMN2MEN1KMT2A
SCHEMBL11492496 0.87 ATM (0.44) MAPTHSP90AA1GPR55SMN1; SMN2MEN1
SCHEMBL11218979 0.86 MAPT (0.42) MAPTHSP90AA1GPR55SMN1; SMN2MEN1
SCHEMBL11594669 0.86 APOBEC3A (0.43) MAPTSMN1; SMN2MEN1KMT2AMAPK1
SCHEMBL11335258 0.86 KCNK9 (0.39) MAPTHSP90AA1SMN1; SMN2MEN1KMT2A
SCHEMBL14564633 0.86 KMT2A (0.46) MAPTSMN1; SMN2MEN1KMT2AMAPK1
SCHEMBL14462088 0.86 SMN1; SMN2 (0.41) MAPTHSP90AA1SMN1; SMN2MEN1KMT2A
SCHEMBL10470820 0.86 SMN1; SMN2 (0.41) MAPTHSP90AA1SMN1; SMN2MEN1KMT2A
SCHEMBL11576017 0.85 SMN1; SMN2 (0.38) MAPTHSP90AA1SMN1; SMN2MEN1KMT2A

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-5672714-A HALOGENATION WITH 1,3-DIHALO-5,5-DIMETHYLHYDANTOIN FOLLOWED BY REACTION WITH 5,5-DIMETHYLHYDANTOIN AT THE HALOGENATION SITE TO FORM PHOTOGRAPHIC YELLOW COUPLER COMPOUND FUJI PHOTO FILM CO., LTD. (JP) 1997-09-30 US disclosed