SCHEMBL10695814

SCHEMBL10695814

CSc1ccc(CCCC(O)Cc2cccnc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
MAPK1 P28482 1/20 0.42
MMP12 P39900 1/20 0.40
MMP13 P45452 1/20 0.40
CYP2A6 P11509 1/20 0.40
FDPS P14324 1/20 0.40
TBXAS1 P24557 5/20 0.39
TRPV1 Q8NER1 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
HRH1 P35367 2/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 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
SCHEMBL10696169 0.85 TBXAS1 (0.49) L3MBTL1TDP1CYP2A6FDPSTBXAS1
SCHEMBL10695591 0.82 PTAFR (0.48) KMT2ATBXAS1HTTSMN1; SMN2
SCHEMBL10694457 0.79 KMT2A (0.46) KMT2AL3MBTL1TDP1TBXAS1HTT
SCHEMBL3923399 0.77 CYP2A6 (0.59) L3MBTL1TDP1CYP2A6TBXAS1HRH1
SCHEMBL10695936 0.77 PTAFR (0.52) L3MBTL1MAPK1ALDH1A1HTT
SCHEMBL7549229 0.76 TBXAS1 (0.55) L3MBTL1TDP1CYP2A6TBXAS1HRH1
SCHEMBL7384270 0.76 TBXAS1 (0.55) L3MBTL1TDP1CYP2A6TBXAS1HRH1
SCHEMBL1741940 0.75 TDP1 (0.57) KMT2AL3MBTL1TDP1FDPSTRPV1
SCHEMBL7803183 0.75 TDP1 (0.60) KMT2AL3MBTL1TDP1CYP2A6TBXAS1
SCHEMBL9522636 0.75 TDP1 (0.60) KMT2AL3MBTL1TDP1CYP2A6TBXAS1

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
EP-0267439-A2 Alpha-(phenylalkyl) pyridinealkanol derivatives G.D. Searle & Co. (US) 1988-05-18 EP claimed
EP-0267439-A2 Alpha-(phenylalkyl) pyridinealkanol derivatives G.D. Searle & Co. (US) 1988-05-18 EP disclosed