SCHEMBL27464372

SCHEMBL27464372

CCCCOC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1

nearest known ligand 0.79

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.79
ALDH1A1 P00352 7/20 0.79
LMNA P02545 4/20 0.79
SMN1; SMN2 Q16637 3/20 0.79
HTT P42858 1/20 0.60
TP53 P04637 1/20 0.60
KMT2A Q03164 2/20 0.56
HRH2 P25021 1/20 0.55
HRH1 P35367 1/20 0.55
MEN1 O00255 1/20 0.55
KDM4E B2RXH2 1/20 0.53
GAA P10253 1/20 0.53
AKR1C3 P42330 1/20 0.53
POLB P06746 1/20 0.53
ENPP2 Q13822 1/20 0.53

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
SCHEMBL24641954 0.93 MAPT (0.83) MAPTALDH1A1LMNASMN1; SMN2HTT
SCHEMBL3568725 0.89 MAPT (0.64) MAPTALDH1A1LMNASMN1; SMN2HTT
SCHEMBL29855926 0.88 MAPT (0.62) MAPTALDH1A1LMNASMN1; SMN2HTT
SCHEMBL8301729 0.86 MGLL (0.64) MAPTALDH1A1LMNASMN1; SMN2KMT2A
SCHEMBL6141536 0.85 KMT2A (0.74) MAPTALDH1A1LMNASMN1; SMN2KMT2A
SCHEMBL3048329 0.84 MAPT (0.73) MAPTALDH1A1LMNASMN1; SMN2HTT
SCHEMBL5539965 0.83 MAPT (0.59) MAPTALDH1A1LMNASMN1; SMN2HTT
SCHEMBL5539971 0.83 MAPT (0.76) MAPTALDH1A1LMNASMN1; SMN2HTT
SCHEMBL29742046 0.83 MAPT (0.58) MAPTALDH1A1LMNASMN1; SMN2HTT
SCHEMBL29742079 0.83 MAPT (0.55) MAPTALDH1A1LMNASMN1; SMN2KMT2A

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
CN-1158269-C 4-aminothiazole derivs, their preparation and their use as inhibitors of cyclin-dependent kinases ������ҩ�����޹�˾ 2004-07-21 CN disclosed
CN-1276789-A 4-aminothiazole derivatives, their preparation and their use as inhibitors of cyclin dependent kinases AGOURON PHARMA (US) 2000-12-13 CN disclosed