SCHEMBL4582632

SCHEMBL4582632

O=C(Cl)c1c(F)c(F)c(F)c(F)c1C(F)(F)F

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.37
TSHR P16473 1/20 0.37
CES2 O00748 1/20 0.37
CES1 P23141 1/20 0.37
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
HTT P42858 1/20 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
SCHEMBL27864039 0.89 SMN1; SMN2 (0.40) SMN1; SMN2TSHRCES2CES1MEN1
SCHEMBL18393827 0.88 SMN1; SMN2 (0.42) SMN1; SMN2TSHRCES2CES1MEN1
SCHEMBL6140455 0.79 SMN1; SMN2 (0.38) SMN1; SMN2TSHRCES2CES1MEN1
SCHEMBL5076184 0.79 SMN1; SMN2 (0.42) SMN1; SMN2TSHRCES2CES1MEN1
SCHEMBL9344460 0.78 ALDH1A1 (0.35) SMN1; SMN2TSHR
SCHEMBL1657 0.77 CES2 (0.48) SMN1; SMN2TSHRCES2CES1MEN1
SCHEMBL19307720 0.77 CES2 (0.48) SMN1; SMN2TSHRCES2CES1MEN1
SCHEMBL7995704 0.76 TSHR (0.32) SMN1; SMN2TSHR
SCHEMBL6538271 0.75 CES2 (0.46) SMN1; SMN2TSHRCES2CES1HTT
SCHEMBL996758 0.74 CES2 (0.43) SMN1; SMN2CES2CES1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8530269-B2 Manufacture of a polymer device CAMBRIDGE ENTERPRISE LTD (GB) 2013-09-10 US disclosed
EP-1631995-B1 MANUFACTURE OF A POLYMER DEVICE CAMBRIDGE ENTPR LTD (GB) 2008-07-16 EP disclosed
US-20070172978-A1 Manufacture of a polymer device CAMBRIDGE UNIVERSITY TECHNICAL SERVICE LIMITED (GB) 2007-07-26 US disclosed