SCHEMBL8315795

SCHEMBL8315795

CCOC(=O)OC1CCC(C2CCCCC2)N1C(=O)Cc1ccc(C)cc1C

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 3/20 0.37
SMN1; SMN2 Q16637 3/20 0.34
POLB P06746 1/20 0.34
P2RX7 Q99572 1/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
HPGD P15428 2/20 0.32
ALDH1A1 P00352 1/20 0.32
CCR2 P41597 2/20 0.32
CALCRL Q16602 1/20 0.32
LMNA P02545 2/20 0.32
CYP3A4 P08684 1/20 0.32
CASP3 P42574 1/20 0.32
TSHR P16473 1/20 0.32
GAA P10253 1/20 0.31
ALOX12 P18054 1/20 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
SCHEMBL8314523 0.87 KMT2A (0.38) CCR1SMN1; SMN2POLBMEN1KMT2A
SCHEMBL8314804 0.84 SIGMAR1 (0.43) SMN1; SMN2POLBP2RX7KMT2AALDH1A1
SCHEMBL8312314 0.84 SMN1; SMN2 (0.38) SMN1; SMN2POLBP2RX7MEN1KMT2A
SCHEMBL8875291 0.84 POLB (0.39) CCR1SMN1; SMN2POLBP2RX7KMT2A
SCHEMBL8312553 0.82 ALDH1A1 (0.40) SMN1; SMN2MEN1KMT2AHPGDALDH1A1
SCHEMBL8314253 0.82 KMT2A (0.36) CCR1SMN1; SMN2POLBMEN1KMT2A
SCHEMBL9536076 0.80 SMN1; SMN2 (0.38) SMN1; SMN2POLBMEN1KMT2AGAA
SCHEMBL8312908 0.79 KMT2A (0.45) SMN1; SMN2POLBMEN1KMT2AALDH1A1
SCHEMBL8313857 0.79 KMT2A (0.35) CCR1SMN1; SMN2POLBMEN1KMT2A
SCHEMBL8317735 0.77 SMN1; SMN2 (0.37) SMN1; SMN2POLBP2RX7MEN1KMT2A

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