SCHEMBL6802291

SCHEMBL6802291

N#Cc1ccc(N(Cc2ccc(O)cc2)C(=O)c2ccccc2)cc1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.76
NPC1 O15118 1/20 0.76
KMT2A Q03164 1/20 0.76
PDK1 Q15118 6/20 0.60
PDK2 Q15119 3/20 0.60
PDK4 Q16654 3/20 0.60
PDK3 Q15120 2/20 0.60
LTB4R2 Q9NPC1 2/20 0.50
PTGES O14684 2/20 0.50
ALOX5 P09917 2/20 0.50
ALDH1A1 P00352 1/20 0.49
CYP19A1 P11511 1/20 0.48
NR1H4 Q96RI1 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2C9 P11712 1/20 0.47
GAA P10253 1/20 0.47
TSHR P16473 1/20 0.47
MAPKAPK2 P49137 1/20 0.47
SNCA P37840 1/20 0.46
NSD2 O96028 1/20 0.46

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
SCHEMBL6799435 0.93 MEN1 (0.72) MEN1NPC1KMT2APDK1PDK2
SCHEMBL27565502 0.88 MEN1 (0.74) MEN1NPC1KMT2APDK1PDK2
SCHEMBL6799801 0.86 GAA (0.62) MEN1NPC1KMT2APDK1PDK2
SCHEMBL6798512 0.83 MEN1 (0.55) MEN1NPC1KMT2APDK1PDK2
SCHEMBL6800721 0.81 MEN1 (0.63) MEN1NPC1KMT2APDK1PDK2
SCHEMBL6800779 0.80 MEN1 (0.55) MEN1NPC1KMT2APDK1PDK2
SCHEMBL1925493 0.80 NPC1 (0.73) MEN1NPC1KMT2ALTB4R2ALDH1A1
SCHEMBL6801305 0.77 CYP19A1 (0.55) MEN1NPC1KMT2APDK1PDK2
SCHEMBL10579072 0.77 MEN1 (0.66) MEN1NPC1KMT2APDK1PDK2
SCHEMBL8332050 0.76 KMT2A (0.71) MEN1NPC1KMT2APDK1LTB4R2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1308297-C Phenyl sulfamate derivs. TEIKOKU HORMONE MFG CO LTD (JP) 2007-04-04 CN disclosed
US-6762205-B1 STEROID SULFATASE INHIBITORS WITHOUT ESTROGENIC SIDE EFFECT ACTION TEIKOKU HORMONE MFG. CO., LTD. (JP) 2004-07-13 US disclosed
CN-1360570-A Phenyl sulfamate derivs. TEIKOKU HORMONE MFG CO LTD (JP) 2002-07-24 CN disclosed
EP-1193250-A1 PHENYL SULFAMATE DERIVATIVES Teikoku Hormone Mfg. Co., Ltd. (JP) 2002-04-03 EP disclosed