SCHEMBL8439401

SCHEMBL8439401

CC1=CC(=O)N(CCCC(C)CN2C(=O)C=C(C)C2=O)C1=O

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TERT O14746 2/20 0.32
FAAH O00519 1/20 0.31
MGLL Q99685 1/20 0.31
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
RGS12 O14924 1/20 0.30
NPC1 O15118 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
PABPC1 P11940 1/20 0.30
HTT P42858 1/20 0.30
RECQL P46063 1/20 0.30
RAB9A P51151 1/20 0.30
KMT2A Q03164 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
MAOB P27338 2/20 0.30

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
SCHEMBL14578297 0.95 MGLL (0.33) TERTFAAHMGLLKDM4EMEN1
SCHEMBL8439290 0.83 MGLL (0.33) TERTFAAHMGLLKDM4EMEN1
SCHEMBL25086785 0.81
SCHEMBL20476742 0.81 KDM4E (0.34) TERTFAAHMGLLKDM4EALDH1A1
SCHEMBL8885500 0.80 MGLL (0.41) TERTFAAHMGLLKDM4EMEN1
SCHEMBL8883684 0.80 MGLL (0.46) TERTFAAHMGLLKDM4EMEN1
SCHEMBL20476511 0.80 PTGS1 (0.33) FAAHMGLLNPC1ALDH1A1RAB9A
SCHEMBL20476513 0.79 MGLL (0.39) FAAHMGLLKDM4EMEN1NPC1
SCHEMBL8885012 0.79 MGLL (0.48) FAAHMGLLKDM4EMEN1RGS12
SCHEMBL8887050 0.79 MGLL (0.48) FAAHMGLLKDM4EMEN1RGS12

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110845387-B Bis (citraconimido) hydrocarbon, preparation method thereof and application thereof as anti-reversion agent 山东阳谷华泰化工股份有限公司 2023-05-09 CN claimed
CN-110845387-B Bis (citraconimido) hydrocarbon, preparation method thereof and application thereof as anti-reversion agent 山东阳谷华泰化工股份有限公司 2023-05-09 CN disclosed
US-20230067259-A1 HEAT-CURABLE RESIN COMPOSITION SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-03-02 US disclosed
EP-0495544-B1 Process for the synthesis of citraconimides AKZO NOBEL NV (NL) 1999-04-07 EP disclosed