SCHEMBL4274472

SCHEMBL4274472

Cc1ncc(C(=O)OCl)cn1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.37
KDM4E B2RXH2 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
HDAC1 Q13547 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
SMYD3 Q9H7B4 1/20 0.33
ATM Q13315 1/20 0.33
NNMT P40261 2/20 0.32
NAPRT Q6XQN6 1/20 0.32
ALDH1A1 P00352 1/20 0.32
ALOX15 P16050 1/20 0.32
HSD17B10 Q99714 1/20 0.32
RAB9A P51151 4/20 0.32
MAPT P10636 3/20 0.32
LMNA P02545 1/20 0.31
POLB P06746 1/20 0.31
PKM P14618 1/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
TP53 P04637 1/20 0.31
TSHR P16473 1/20 0.31

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
SCHEMBL4128911 0.80 MAPK1 (0.57) MAPK1KDM4EL3MBTL1ATMALDH1A1
SCHEMBL26145810 0.78 MAPK1 (0.37) MAPK1KDM4EL3MBTL1HDAC1HDAC6
SCHEMBL27892719 0.78 HDAC1 (0.55) MAPK1KDM4EL3MBTL1HDAC1HDAC6
SCHEMBL2642000 0.77 CYP2C9 (0.53) MAPK1ATMALDH1A1RAB9AMAPT
SCHEMBL25659553 0.75 CA12 (0.40) MAPK1ALDH1A1NFKB1NFKB2RELA
SCHEMBL4123825 0.75 NAPRT (0.40) MAPK1KDM4EHDAC1HDAC6SMYD3
SCHEMBL20267759 0.72 LMNA (0.55) MAPK1KDM4EL3MBTL1ALDH1A1RAB9A
SCHEMBL2175856 0.72 KCNJ1 (0.39) MAPK1KDM4EL3MBTL1HDAC1HDAC6
SCHEMBL185619 0.72 ALDH1A1 (0.58) KDM4ENAPRTALDH1A1ALOX15HSD17B10
SCHEMBL669121 0.72 NNMT (0.52) KDM4EL3MBTL1SMYD3NNMTHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2063897-A2 KINASE INHIBITORS USEFUL FOR THE TREATMENT OF PROLIFERATIVE DISEASES Deciphera Pharmaceuticals, LLC. (US) 2009-06-03 EP disclosed
WO-2008034008-A2 KINASE INHIBITORS USEFUL FOR THE TREATMENT OF PROLIFERATIVE DISEASES DECIPHERA PHARMACEUTICALS, LLC. (US) 2008-03-20 WO disclosed
WO-1997009325-A1 PYRIMIDINE CARBOXYLATES AND RELATED COMPOUNDS AND METHODS FOR TREATING INFLAMMATORY CONDITIONS SIGNAL PHARMACEUTICALS, INC. (US) 1997-03-13 WO disclosed