SCHEMBL2493638

SCHEMBL2493638

CCN(C(=O)Oc1ccc(N)cc1)C(C)(C)C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
ALDH1A1 P00352 5/20 0.43
NFKB1 P19838 5/20 0.43
NFKB2 Q00653 5/20 0.43
RELA Q04206 5/20 0.43
MAPT P10636 4/20 0.43
HTT P42858 1/20 0.43
RAB9A P51151 3/20 0.43
SMN1; SMN2 Q16637 1/20 0.41
HSD17B10 Q99714 1/20 0.41
BCHE P06276 3/20 0.40
NPC1 O15118 1/20 0.39
TSHR P16473 3/20 0.39
TDP1 Q9NUW8 1/20 0.39
MAOA P21397 2/20 0.38
CYP2D6 P10635 1/20 0.38
HTR3A P46098 1/20 0.38
HRH3 Q9Y5N1 1/20 0.38
LMNA P02545 2/20 0.38

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
SCHEMBL27774480 0.85 MEN1 (0.53) MEN1KMT2AALDH1A1NFKB1NFKB2
SCHEMBL12086366 0.84 KMT2A (0.51) MEN1KMT2AALDH1A1NFKB1NFKB2
SCHEMBL27578920 0.84 MEN1 (0.51) MEN1KMT2AALDH1A1NFKB1NFKB2
SCHEMBL27766267 0.83 KMT2A (0.50) MEN1KMT2AALDH1A1NFKB1NFKB2
SCHEMBL28868300 0.83 MEN1 (0.44) MEN1KMT2AALDH1A1NFKB1NFKB2
SCHEMBL27445939 0.82 CYP3A4 (0.45) MEN1KMT2AALDH1A1BCHETSHR
SCHEMBL28941287 0.81 LMNA (0.42) MEN1KMT2AALDH1A1NFKB1NFKB2
SCHEMBL6189602 0.80 KMT2A (0.47) MEN1KMT2AALDH1A1NFKB1NFKB2
SCHEMBL28941154 0.80 MEN1 (0.41) MEN1KMT2AALDH1A1NFKB1NFKB2
SCHEMBL19439086 0.80 MEN1 (0.81) MEN1KMT2AALDH1A1NFKB1NFKB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111051309-B Triazolotriazine derivatives useful as A2A receptor antagonists 浙江春禾医药科技有限公司 2023-05-26 CN disclosed
CN-101678215-B Sulfonamide derivatives for the treatment of abnormal cell growth PFIZER PRODUCTS INC. (US) 2014-10-01 CN disclosed
CN-103951658-A Sulfonyl amide derivatives for the treatment of abnormal cell growth PFIZER PROD INC 2014-07-30 CN disclosed
EP-1518855-B1 DIAMINOPYRIMIDINECARBOXA MIDE DERIVATIVE ASTELLAS PHARMA INC (JP) 2011-10-26 EP disclosed
CN-101678215-A Sulfonamide derivatives for the treatment of abnormal cell growth PFIZER PROD INC 2010-03-24 CN disclosed