SCHEMBL5739082

SCHEMBL5739082

CCCCCC(CCC)CO[C]=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.39
CA1 P00915 2/20 0.38
CA12 O43570 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38
CA14 Q9ULX7 1/20 0.38
CYP3A4 P08684 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MAPT P10636 1/20 0.34
PRSS1 P07477 1/20 0.34
PRSS2 P07478 1/20 0.34
PRSS3 P35030 1/20 0.34
TSHR P16473 2/20 0.33
ATM Q13315 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
FDPS P14324 4/20 0.32
SMPD1 P17405 3/20 0.32
OPRM1 P35372 1/20 0.32
ZDHHC7 Q9NXF8 1/20 0.32
GPR84 Q9NQS5 3/20 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
SCHEMBL8634225 0.96 LMNA (0.41) LMNACA1CYP3A4L3MBTL1MAPT
SCHEMBL3040106 0.94 CYP3A4 (0.41) LMNACA1CA12CA2CA7
SCHEMBL7209537 0.94 LMNA (0.45) LMNACYP3A4L3MBTL1MAPTPRSS1
SCHEMBL7204580 0.94 LMNA (0.45) LMNACYP3A4L3MBTL1MAPTPRSS1
SCHEMBL7205358 0.94 LMNA (0.45) LMNACYP3A4L3MBTL1MAPTPRSS1
SCHEMBL22342662 0.89 CA12 (0.45) CA1CA12CA2CA7CA14
SCHEMBL3030454 0.88 CYP3A4 (0.48) LMNACA2CYP3A4L3MBTL1PRSS1
SCHEMBL10527246 0.88 PRSS1 (0.42) LMNACA2CYP3A4L3MBTL1MAPT
SCHEMBL1110039 0.86 CYP3A4 (0.47) LMNACA2CYP3A4L3MBTL1MAPT
SCHEMBL96307 0.82 CYP3A4 (0.55) LMNACA2CYP3A4L3MBTL1PRSS1

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-1636192-A1 3-ALKYLIDENEHYDRAZINO SUBSTITUTED HETEROARYL COMPOUNDS AS THROMBOPOIETIN RECEPTOR ACTIVATORS Nissan Chemical Industries, Ltd. (JP) 2006-03-22 EP disclosed
WO-2004108683-A1 3-ALKYLIDENEHYDRAZINO SUBSTITUTED HETEROARYL COMPOUNDS AS THROMBOPOIETIN RECEPTOR ACTIVATORS NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2004-12-16 WO disclosed