SCHEMBL8551838

SCHEMBL8551838

COC(=O)c1cc(Cc2ccccc2Cl)c2c(C(C)=O)c(C)[nH]c2c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
PDE3B Q13370 1/20 0.55
PDE3A Q14432 1/20 0.55
HTT P42858 2/20 0.47
ALDH1A1 P00352 2/20 0.47
PKM P14618 2/20 0.47
MAPK1 P28482 1/20 0.47
ALOX5 P09917 2/20 0.44
TSHR P16473 2/20 0.44
GAA P10253 1/20 0.44
NR4A2 P43354 1/20 0.42
PTGES O14684 1/20 0.41
BRD4 O60885 1/20 0.41
MAPT P10636 3/20 0.41
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
NFKB1 P19838 1/20 0.40

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
SCHEMBL8557456 0.89 LMNA (0.48) LMNASMN1; SMN2PDE3BPDE3AHTT
SCHEMBL8553605 0.87 ALOX5 (0.48) LMNASMN1; SMN2PDE3BPDE3AHTT
SCHEMBL8551585 0.85 SMN1; SMN2 (0.48) LMNASMN1; SMN2PDE3BPDE3AHTT
SCHEMBL8557469 0.80 PDE3B (0.52) LMNASMN1; SMN2PDE3BPDE3AALOX5
SCHEMBL8551933 0.79 PDE3B (0.51) LMNASMN1; SMN2PDE3BPDE3AALOX5
SCHEMBL8555588 0.78 SMN1; SMN2 (0.47) LMNASMN1; SMN2PDE3BPDE3AHTT
SCHEMBL8554409 0.77 LMNA (0.47) LMNASMN1; SMN2PDE3BPDE3AALOX5
SCHEMBL8554381 0.77 PDE3B (0.48) LMNASMN1; SMN2PDE3BPDE3AALOX5
SCHEMBL7707823 0.76 ALOX5 (0.44) LMNASMN1; SMN2PDE3BPDE3AHTT
SCHEMBL8557542 0.74 LMNA (0.42) LMNASMN1; SMN2PDE3BPDE3AHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0572001-B1 Furobenzopyran derivatives, process for preparation of same and herbicides containing same as active components MITSUI CHEMICALS INC (JP) 1998-08-05 EP disclosed
US-5530146-A TETRAHYDROFURAN DERIVATIVE INTERMEDIATES MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1996-06-25 US disclosed
US-5356866-A Completely selective to crops such as paddy rice, soybeans and cotton MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1994-10-18 US disclosed
EP-0572001-A1 Furobenzopyran derivatives, process for preparation of same and herbicides containing same as active components MITSUI TOATSU CHEMICALS, Inc. (JP) 1993-12-01 EP disclosed