SCHEMBL6801166

SCHEMBL6801166

CCN(C(=O)c1ccc(O)cc1)c1ccc(O)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 2/20 0.58
ESR2 Q92731 2/20 0.58
ALDH1A1 P00352 4/20 0.54
HPGD P15428 1/20 0.54
MLYCD O95822 2/20 0.49
HDAC8 Q9BY41 2/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
HTT P42858 1/20 0.47
CYP3A4 P08684 2/20 0.47
CYP2C9 P11712 1/20 0.47
PDK1 Q15118 1/20 0.47
PDK2 Q15119 1/20 0.47
PDK3 Q15120 1/20 0.47
PDK4 Q16654 1/20 0.47
HSD17B3 P37058 1/20 0.46
GLA P06280 1/20 0.46
TSHR P16473 1/20 0.46
ESRRG P62508 2/20 0.44
LMNA P02545 1/20 0.44

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
SCHEMBL11139418 0.89 HDAC8 (0.54) ESR1ESR2ALDH1A1HPGDMLYCD
SCHEMBL11142927 0.83 HDAC8 (0.49) ESR1ESR2ALDH1A1HPGDMLYCD
SCHEMBL11139420 0.83 ESR1 (0.58) ESR1ESR2ALDH1A1HPGDMLYCD
SCHEMBL18840276 0.82 ALDH1A1 (0.67) ESR1ESR2ALDH1A1HPGDMLYCD
SCHEMBL6801988 0.80 TSHR (0.58) ALDH1A1HPGDMEN1KMT2AHTT
SCHEMBL6421500 0.80 ALDH1A1 (0.48) ESR1ESR2ALDH1A1HPGDMLYCD
SCHEMBL10926482 0.80 ALDH1A1 (0.48) ESR1ESR2ALDH1A1HPGDMLYCD
SCHEMBL5702149 0.80 ALDH1A1 (0.53) ESR1ESR2ALDH1A1MEN1KMT2A
SCHEMBL3656192 0.79 ALDH1A1 (0.51) ESR1ESR2ALDH1A1HPGDMEN1
SCHEMBL1006444 0.78 HTT (0.71) ALDH1A1HPGDMEN1KMT2AHTT

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