SCHEMBL8312908

SCHEMBL8312908

CCOC(=O)OC1CCC(C2CCCCC2)N1C(=O)Cc1c(Cl)cccc1Cl

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.45
GAA P10253 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.43
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 6/20 0.41
KDM4E B2RXH2 5/20 0.41
TDP1 Q9NUW8 3/20 0.41
SIGMAR1 Q99720 1/20 0.41
TSHR P16473 2/20 0.38
POLB P06746 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
DRD1 P21728 2/20 0.35
ALOX15 P16050 1/20 0.35
KCNH2 Q12809 1/20 0.35
MAPT P10636 1/20 0.34
TP53 P04637 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 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
SCHEMBL9220150 0.97 KMT2A (0.44) KMT2AGAASMN1; SMN2MEN1ALDH1A1
SCHEMBL8314253 0.90 KMT2A (0.36) KMT2AGAASMN1; SMN2MEN1ALDH1A1
SCHEMBL8318010 0.84 KMT2A (0.47) KMT2AGAASMN1; SMN2MEN1ALDH1A1
SCHEMBL8876411 0.83 KMT2A (0.51) KMT2AGAASMN1; SMN2MEN1ALDH1A1
SCHEMBL8314523 0.83 KMT2A (0.38) KMT2AGAASMN1; SMN2MEN1ALDH1A1
SCHEMBL8314804 0.83 SIGMAR1 (0.43) KMT2ASMN1; SMN2ALDH1A1SIGMAR1TSHR
SCHEMBL8317246 0.82 KMT2A (0.45) KMT2AGAASMN1; SMN2MEN1ALDH1A1
SCHEMBL9443610 0.80 KMT2A (0.50) KMT2AGAASMN1; SMN2MEN1ALDH1A1
SCHEMBL9538257 0.80 KMT2A (0.49) KMT2AGAASMN1; SMN2MEN1ALDH1A1
SCHEMBL8315795 0.79 CCR1 (0.37) KMT2AGAASMN1; SMN2MEN1ALDH1A1

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-0501129-B1 Substituted bicyclic 3-arylpyrrolidin-2,4-dion derivatives BAYER AG (DE) 1999-07-14 EP disclosed
EP-0501129-A1 Substituted bicyclic 3-arylpyrrolidin-2,4-dion derivatives BAYER AG (DE) 1992-09-02 EP disclosed