SCHEMBL19590926

SCHEMBL19590926

CC1CCC(=O)N(CCc2ccc(-c3ccc(C(F)(F)F)cc3)o2)C1=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIN1 Q13526 1/20 0.39
PRMT1 Q99873 1/20 0.38
HSP90AA1 P07900 1/20 0.33
ALDH1A1 P00352 3/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
MMP13 P45452 1/20 0.33
KCNH2 Q12809 1/20 0.33
MCHR1 Q99705 1/20 0.33
CCNT1 O60563 1/20 0.33
CCNA2 P20248 1/20 0.33
CDK2 P24941 1/20 0.33
CDK9 P50750 1/20 0.33
P2RX7 Q99572 1/20 0.32
SRD5A1 P18405 1/20 0.32
CYP1A2 P05177 2/20 0.32
CYP2C19 P33261 2/20 0.32
KDM4E B2RXH2 1/20 0.32
DDAH1 O94760 1/20 0.32

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
SCHEMBL19590922 0.83 PIN1 (0.43) PIN1PRMT1HSP90AA1ALDH1A1SMN1; SMN2
SCHEMBL19588483 0.69 ALDH1A1 (0.51) PIN1ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL19590924 0.67 ALDH1A1 (0.54) PIN1ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL4438540 0.67 ALDH1A1 (0.63) PIN1PRMT1HSP90AA1ALDH1A1SMN1; SMN2
SCHEMBL19590925 0.67 ALDH1A1 (0.50) PIN1ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL13680869 0.66 PRMT1 (0.46) PIN1PRMT1HSP90AA1ALDH1A1SMN1; SMN2
SCHEMBL22538998 0.65 CHRM1 (0.33) KMT2A
SCHEMBL13334716 0.64 ABCB1 (0.54) ALDH1A1KCNH2KDM4EMAPT
SCHEMBL27769702 0.64 PRMT1 (0.44) PIN1PRMT1HSP90AA1ALDH1A1SMN1; SMN2
SCHEMBL13334633 0.64 ABCB1 (0.48) PIN1PRMT1ALDH1A1SMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9815814-B2 Glutarimide derivatives, use thereof, pharmaceutical composition based thereon and methods for producing glutarimide derivatives Obschestvo S Ogranichennoi Otvetstvennostiyu “Pharmenterprises” (RU) 2017-11-14 US disclosed