SCHEMBL7828097

SCHEMBL7828097

CCOC(=O)c1[nH]nc(C)c1Cc1ccc(Cl)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.50
MAPT P10636 4/20 0.50
NPC1 O15118 1/20 0.50
TP53 P04637 1/20 0.50
RAB9A P51151 1/20 0.50
CDC25B P30305 1/20 0.50
AR P10275 1/20 0.49
ALPL P05186 1/20 0.48
ALDH1A1 P00352 3/20 0.46
HPGD P15428 2/20 0.46
NPSR1 Q6W5P4 2/20 0.46
KDM4E B2RXH2 2/20 0.46
P2RX7 Q99572 1/20 0.46
TNF P01375 1/20 0.46
HSP90AA1 P07900 1/20 0.46
ALOX12 P18054 1/20 0.46
CCR6 P51684 1/20 0.46
RUNX1 Q01196 1/20 0.46
CBFB Q13951 1/20 0.46
HKDC1 Q2TB90 1/20 0.46

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
SCHEMBL8188646 0.89 AR (0.51) LMNAMAPTNPC1RAB9AAR
SCHEMBL6418611 0.87 AR (0.49) LMNAMAPTNPC1TP53RAB9A
SCHEMBL5025427 0.86 ALDH1A1 (0.52) LMNAMAPTNPC1TP53RAB9A
SCHEMBL7817971 0.83 MEN1 (0.57) LMNAMAPTNPC1TP53RAB9A
SCHEMBL20489232 0.82 ALDH1A1 (0.45) LMNAMAPTTP53ARALDH1A1
SCHEMBL20488236 0.78 MAPT (0.38) LMNAMAPTNPC1TP53CDC25B
SCHEMBL2874155 0.75 PDE4D (0.58) MAPTCDC25BALPLALDH1A1HPGD
SCHEMBL28266776 0.75 AR (0.60) LMNAMAPTNPC1RAB9AAR
SCHEMBL20897262 0.74 ALPL (0.64) LMNAMAPTNPC1TP53RAB9A
SCHEMBL22272868 0.72 LMNA (0.54) LMNAMAPTNPC1TP53RAB9A

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-1066257-A2 HETEROCYLIC CLASSES OF COMPOUNDS FOR THE MODULATING TYROSINE PROTEIN KINASE Sugen, Inc. (US) 2001-01-10 EP disclosed
WO-1999048868-A9 HETEROCYCLIC CLASSES OF COMPOUNDS FOR THE MODULATING TYROSINE PROTEIN KINASE SUGEN INC (US) 2000-04-20 WO disclosed
WO-1999048868-A2 HETEROCYCLIC CLASSES OF COMPOUNDS FOR THE MODULATING TYROSINE PROTEIN KINASE SUGEN, INC. (US) 1999-09-30 WO disclosed