SCHEMBL27745563

SCHEMBL27745563

CNc1ccc(-c2ccccc2)c(-c2nnn[nH]2)c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 1/20 0.34
MEN1 O00255 1/20 0.33
APAF1 O14727 1/20 0.33
NPC1 O15118 1/20 0.33
POLB P06746 1/20 0.33
PABPC1 P11940 1/20 0.33
MMP14 P50281 1/20 0.33
BLM P54132 1/20 0.33
CASP6 P55212 1/20 0.33
KMT2A Q03164 1/20 0.33
ABCB1 P08183 1/20 0.33
ABCC1 P33527 1/20 0.33
ABCG2 Q9UNQ0 1/20 0.33
TDO2 P48775 1/20 0.33
TSHR P16473 1/20 0.32
AKT1 P31749 1/20 0.32
AKT2 P31751 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
PIM1 P11309 1/20 0.32
PIM3 Q86V86 1/20 0.32

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
Hydrochloric Acid SCHEMBL28773310 0.99 PDK2 (0.33) PDK2MEN1APAF1NPC1POLB
SCHEMBL2160591 0.81 METAP2 (0.41) MEN1NPC1POLBKMT2ATSHR
SCHEMBL29034386 0.78 DCUN1D1 (0.45) NPC1ABCG2AKT1AKT2DCUN1D2
SCHEMBL3397570 0.78 DCUN1D1 (0.47) NPC1ABCG2AKT1AKT2DCUN1D2
SCHEMBL29499607 0.78 DCUN1D1 (0.47) NPC1ABCG2AKT1AKT2DCUN1D2
SCHEMBL9539905 0.78 DCUN1D1 (0.33) AKT1AKT2DCUN1D2DCUN1D1
SCHEMBL12017490 0.77 BTK (0.41) MEN1POLBKMT2ATSHRNTRK1
SCHEMBL9709791 0.76 LMNA (0.48) NPC1POLBKMT2AABCB1ABCG2
SCHEMBL1774163 0.75 FOLH1 (0.37) PDK2TSHRTDP1
SCHEMBL1463312 0.75 KDR (0.48) MEN1NPC1KMT2APIM1JAK2

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-101268065-A Process for preparing an angiotensin II receptor antagonist FARMAPROJECTS S L (ES) 2008-09-17 CN claimed
CN-101268065-A Process for preparing an angiotensin II receptor antagonist FARMAPROJECTS S L (ES) 2008-09-17 CN disclosed