SCHEMBL29846007

SCHEMBL29846007

CC(C)(C)Cn1c(Cc2ccccn2)nc2ccccc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.50
KDM4E B2RXH2 2/20 0.47
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
GAA P10253 1/20 0.46
PKM P14618 1/20 0.46
HTT P42858 2/20 0.45
ALOX15 P16050 1/20 0.45
TSHR P16473 1/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
TP53 P04637 3/20 0.45
LMNA P02545 2/20 0.44
KCNH2 Q12809 1/20 0.42
ALOX5AP P20292 1/20 0.42
MAPT P10636 1/20 0.42
NPSR1 Q6W5P4 2/20 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
SCHEMBL20715440 0.80 ALDH1A1 (0.46) ALDH1A1KDM4EMEN1KMT2AGAA
SCHEMBL15978916 0.79 MEN1 (0.68) MEN1KMT2AGAAPKMHTT
SCHEMBL2757849 0.79 LMNA (0.73) ALDH1A1KDM4EMEN1KMT2AHTT
SCHEMBL15082839 0.75 TP53 (0.69) KDM4EMEN1KMT2AGAATSHR
SCHEMBL1537674 0.74 SMN1; SMN2 (0.55) MEN1KMT2AGAAPKMHTT
SCHEMBL9667153 0.72 ALDH1A1 (0.50) ALDH1A1KDM4EMEN1KMT2AHTT
SCHEMBL13111951 0.72 TNF (0.60) ALDH1A1PKMHTTTSHRSMN1; SMN2
SCHEMBL29090786 0.71 HRH1 (0.56) ALDH1A1KDM4EMEN1KMT2AHTT
SCHEMBL990194 0.71 HTT (0.67) KMT2AHTTTP53CYP1A2CYP2D6
SCHEMBL13071435 0.71 MEN1 (0.47) ALDH1A1MEN1KMT2AGAAPKM

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-4073077-A1 HYDROSILYLABLE MIXTURE INCLUDING STRONG ELECTRON DONORS, AS CATALYST ADDITIVE Wacker Chemie AG (DE) 2022-10-19 EP disclosed
CN-114901668-A Hydrosilylation mixtures comprising a strong electron donor as catalyst additive 瓦克化学股份公司 2022-08-12 CN disclosed