SCHEMBL9404756

SCHEMBL9404756

CCN(CC)CCNc1ccc(NC(C)=O)c2c1SCCC2=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 3/20 0.39
ALDH1A1 P00352 2/20 0.39
NFKB1 P19838 1/20 0.39
TERT O14746 3/20 0.39
POLB P06746 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
CYP3A4 P08684 2/20 0.39
THRB P10828 1/20 0.39
BLM P54132 1/20 0.39
ATM Q13315 1/20 0.39
CHEK1 O14757 1/20 0.38
PIM1 P11309 1/20 0.38
IDO1 P14902 1/20 0.38
LTK P29376 1/20 0.38
LIMK1 P53667 1/20 0.38
CLK4 Q9HAZ1 1/20 0.38
MAPT P10636 4/20 0.36
RAD52 P43351 3/20 0.36
KMT2A Q03164 3/20 0.36
CHRM2 P08172 2/20 0.36

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
SCHEMBL9404911 0.85 TERT (0.35) KCNH2ALDH1A1NFKB1TERTPOLB
SCHEMBL9404893 0.84 SMN1; SMN2 (0.38) TERTPOLBSMN1; SMN2HRH3HIF1A
SCHEMBL7657838 0.78 ALDH1A1 (0.38) ALDH1A1POLBSMN1; SMN2MAPTKMT2A
SCHEMBL9404925 0.76 POLB (0.41) ALDH1A1POLBSMN1; SMN2MAPTRAB9A
SCHEMBL7664272 0.76 ALDH1A1 (0.39) ALDH1A1POLBCYP3A4MAPTKMT2A
SCHEMBL7653076 0.75 HDAC1 (0.38) ALDH1A1POLBMAPTKMT2ARAB9A
SCHEMBL9404891 0.75 TSHR (0.36) MAOA
SCHEMBL9404931 0.75 MAOA (0.33) ALDH1A1POLBTHRBMAPTRAB9A
SCHEMBL9404941 0.73 ALDH1A1 (0.43) ALDH1A1POLBSMN1; SMN2KMT2ARAB9A
SCHEMBL9404879 0.72 ALDH1A1 (0.36) ALDH1A1POLBMAPTKMT2ARAB9A

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-0296597-B1 Hexa-cyclic compound DAIICHI SEIYAKU CO (JP) 1994-09-21 EP disclosed
US-5061795-A ANTITUMOR AGENTS DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1991-10-29 US disclosed
US-4939255-A Hexa-cyclic camptothecin derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1990-07-03 US disclosed