SCHEMBL17620396

SCHEMBL17620396

CN1CCN(c2ccc3c4c(cccc24)C(=O)N(OS(=O)(=O)C(F)(F)F)C3=O)CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD1 O95696 5/20 0.50
BRPF1 P55201 5/20 0.50
TAF1 P21675 4/20 0.50
KMT2A Q03164 12/20 0.49
MEN1 O00255 11/20 0.49
USP2 O75604 5/20 0.49
LMNA P02545 5/20 0.49
CASP1 P29466 3/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
CASP7 P55210 2/20 0.49
GAA P10253 1/20 0.49
L3MBTL1 Q9Y468 4/20 0.47
MAPK1 P28482 3/20 0.47
RAB9A P51151 2/20 0.47
MAPT P10636 6/20 0.45
NPC1 O15118 1/20 0.45
AVPR1A P37288 1/20 0.45
HTT P42858 4/20 0.44
TLR9 Q9NR96 2/20 0.44
BRD4 O60885 3/20 0.42

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
SCHEMBL17613112 0.91 MEN1 (0.53) BRD1BRPF1TAF1KMT2AMEN1
SCHEMBL17599282 0.90 MEN1 (0.55) BRD1BRPF1TAF1KMT2AMEN1
SCHEMBL17620402 0.87 MEN1 (0.53) BRD1BRPF1TAF1KMT2AMEN1
SCHEMBL17620399 0.87 MEN1 (0.44) BRD1BRPF1TAF1KMT2AMEN1
SCHEMBL17620403 0.87 MCL1 (0.53) KMT2AMEN1USP2LMNACASP1
SCHEMBL17613110 0.81 KMT2A (0.43) KMT2AMEN1USP2LMNACASP1
SCHEMBL17613111 0.79 KMT2A (0.42) BRD1BRPF1TAF1KMT2AMEN1
SCHEMBL17231442 0.77 KMT2A (0.46) KMT2AMEN1USP2LMNASMN1; SMN2
SCHEMBL17146962 0.77 MAPT (0.46) KMT2AMEN1USP2LMNAL3MBTL1
SCHEMBL22228999 0.77 KMT2A (0.47) KMT2AMEN1USP2LMNASMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3182203-A1 A COMBINATION OF NIT DERIVATIVES WITH SENSITIZERS Heraeus Precious Metals North America Daychem LLC (US) 2017-06-21 EP disclosed
WO-2016043558-A1 PHOTO-ACID GENERATING AGENT HERAEUS MATERIALS KOREA CORPORATION (KR) 2016-03-24 WO disclosed