SCHEMBL9550372

SCHEMBL9550372

O=C(O)CCC1CC=CCC1CCC(=O)O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.38
ALKBH5 Q6P6C2 1/20 0.38
SUCNR1 Q9BXA5 1/20 0.38
EGLN1 Q9GZT9 1/20 0.38
HSD17B10 Q99714 3/20 0.36
KMT2A Q03164 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
ALOX5 P09917 1/20 0.35
SLC22A6 Q4U2R8 1/20 0.35
TSHR P16473 3/20 0.34
PMP22 Q01453 2/20 0.34
CYP2C9 P11712 1/20 0.34
MEN1 O00255 1/20 0.34
NR1I2 O75469 1/20 0.34
ALDH1A1 P00352 1/20 0.34
POLB P06746 1/20 0.34
THRB P10828 1/20 0.34
ACHE P22303 1/20 0.34
APEX1 P27695 1/20 0.34
RECQL P46063 1/20 0.34

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
SCHEMBL25660621 0.80 LMNA (0.38) LMNAALKBH5SUCNR1EGLN1HSD17B10
SCHEMBL21085153 0.78 HSD17B10 (0.38) LMNAALKBH5SUCNR1EGLN1HSD17B10
SCHEMBL9170323 0.76 LMNA (0.44) LMNAALKBH5SUCNR1EGLN1HSD17B10
SCHEMBL16512741 0.74 SLC6A12 (0.50) ALOX5SLC6A12SLC6A11SLC6A13GRM5
SCHEMBL16499292 0.74 SLC6A12 (0.50) ALOX5SLC6A12SLC6A11SLC6A13GRM5
SCHEMBL2466288 0.74 SLC6A12 (0.50) ALOX5SLC6A12SLC6A11SLC6A13GRM5
SCHEMBL23454432 0.73
SCHEMBL21085164 0.72 HSD17B10 (0.34) LMNAHSD17B10KMT2ATDP1TSHR
SCHEMBL8158503 0.72 ALDH1A1 (0.43) LMNAALKBH5SUCNR1EGLN1HSD17B10
SCHEMBL9183918 0.72 KDM4E (0.41) LMNAHSD17B10KMT2ATDP1TSHR

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
US-5216173-A Curing agents for epoxy resins; polyimides HENKEL RESEARCH CORPORATION (US) 1993-06-01 US disclosed
EP-0484381-A1 N-CYANOIMIDES AND PROCESS FOR THEIR PREPARATION AND USES THEREOF HENKEL RESEARCH CORPORATION (US) 1992-05-13 EP disclosed
WO-1991001307-A2 N-CYANOIMIDES AND PROCESS FOR THEIR PREPARATION AND USES THEREOF HENKEL RESEARCH CORPORATION (US) 1991-02-07 WO disclosed