SCHEMBL28054684

SCHEMBL28054684

COc1ccc(CNc2c(C(=O)O)c(C)nc3cccc(C)c23)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.47
ASPH Q12797 2/20 0.47
KDM8 Q8N371 2/20 0.47
APP P05067 2/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
EGFR P00533 1/20 0.44
ALDH1A1 P00352 1/20 0.44
MAPT P10636 1/20 0.43
P2RX3 P56373 1/20 0.42
HIF1A Q16665 1/20 0.42
PPARA Q07869 1/20 0.42
NCF1 P14598 1/20 0.42
THRB P10828 1/20 0.42
CD38 P28907 1/20 0.41
ACP1 P24666 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41

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
SCHEMBL617925 0.89 MAPT (0.51) KDM4EMEN1KMT2AALDH1A1MAPT
SCHEMBL7654278 0.80 MEN1 (0.42) KDM4EAPPMEN1KMT2AALDH1A1
SCHEMBL6652586 0.74 KMT2A (0.60) KDM4EAPPMEN1KMT2AALDH1A1
SCHEMBL7554973 0.73 APP (0.39) APPMEN1KMT2AMAPTPPARA
SCHEMBL6653145 0.72 CTNNB1 (0.36) APPMEN1KMT2AMAPT
SCHEMBL27464342 0.72 SMN1; SMN2 (0.41) APPMEN1KMT2ACYP3A4CYP2C9
SCHEMBL3115205 0.71 CCNE2 (0.51) APPEGFRACP1
SCHEMBL7653573 0.71 APP (0.52) APPMEN1KMT2AALDH1A1
SCHEMBL27464341 0.71 CTNNB1 (0.37) KDM4EAPPMEN1KMT2AALDH1A1
SCHEMBL24987203 0.70 KDM4E (0.50) KDM4EASPHKDM8EGFRALDH1A1

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-106107406-A Improve the method for the stability of sweetness enhancers and comprise the compositions of stable sweetness enhancers 赛诺米克斯公司 2016-11-16 CN disclosed
CN-103153096-B Methods of improving the stability of sweetness enhancers and compositions comprising stable sweetness enhancers 赛诺米克斯公司 2016-08-03 CN disclosed
CN-102933081-B Sweet flavor modifier SENOMYX, INC. (US) 2016-04-13 CN disclosed
CN-103153096-A Methods of improving the stability of sweetness enhancers and compositions comprising stable sweetness enhancers SENOMYX INC 2013-06-12 CN disclosed