SCHEMBL8878084

SCHEMBL8878084

CC(C)COC(=O)c1cc(N2C(=O)CC(C(F)(F)F)CC2=O)c(F)cc1Cl

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.39
MAPT P10636 2/20 0.39
LMNA P02545 1/20 0.39
HPGD P15428 1/20 0.39
PPOX P50336 3/20 0.38
GAA P10253 3/20 0.36
ALDH1A1 P00352 4/20 0.35
TSHR P16473 1/20 0.35
POLB P06746 2/20 0.34
HTT P42858 1/20 0.34
USP2 O75604 1/20 0.34
CYP1A2 P05177 1/20 0.33
CYP2C19 P33261 1/20 0.33
KDM4E B2RXH2 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
SCHEMBL9211922 0.86 PPOX (0.36) SMN1; SMN2MAPTLMNAHPGDPPOX
SCHEMBL8878819 0.81 TSHR (0.36) SMN1; SMN2LMNAHPGDPPOXALDH1A1
SCHEMBL8876677 0.80 EPHX2 (0.36) SMN1; SMN2MAPTLMNAHPGDPPOX
SCHEMBL8879992 0.80 HPGD (0.33) SMN1; SMN2MAPTHPGDPPOXTSHR
SCHEMBL9220170 0.78 POLB (0.37) SMN1; SMN2MAPTLMNAHPGDPPOX
SCHEMBL8877805 0.76 PPOX (0.38) PPOX
SCHEMBL8877808 0.75 PPOX (0.40) PPOX
SCHEMBL9250353 0.74 HPGD (0.63) SMN1; SMN2MAPTLMNAHPGDGAA
SCHEMBL8879045 0.74 PPOX (0.35) PPOXALDH1A1
SCHEMBL8878503 0.74 PPOX (0.32) PPOX

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5631209-A ALGICIDES ROHM AND HAAS COMPANY (US) 1997-05-20 US disclosed
US-5502027-A ALGICIDES ROHM AND HAAS COMPANY (US) 1996-03-26 US disclosed
EP-0415642-B1 Glutarimides ROHM & HAAS (US) 1995-12-06 EP disclosed
US-5393735-A N-(halo-oxy-)phenyl substituted cyclic imides ROHM AND HAAS COMPANY (US) 1995-02-28 US disclosed
EP-0415642-A1 Glutarimides ROHM AND HAAS COMPANY (US) 1991-03-06 EP disclosed