SCHEMBL8039699

SCHEMBL8039699

COC(=O)c1ccccc1NC(=O)C(Oc1ccc(OCc2ccccc2)cc1)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.58
TDP1 Q9NUW8 2/20 0.58
ALDH1A1 P00352 8/20 0.53
KDM4E B2RXH2 6/20 0.53
HSD17B10 Q99714 2/20 0.53
GAA P10253 2/20 0.53
MAPK10 P53779 1/20 0.53
HPGD P15428 2/20 0.52
LMNA P02545 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
SMN1; SMN2 Q16637 2/20 0.49
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
LNPEP Q9UIQ6 3/20 0.48
MAPK1 P28482 1/20 0.48
LTA4H P09960 1/20 0.48
KMT2A Q03164 1/20 0.48
MAPT P10636 3/20 0.48
SIRT2 Q8IXJ6 1/20 0.47
POLB P06746 1/20 0.47

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
SCHEMBL8037897 0.90 CTSV (0.52) LMNASMN1; SMN2NPC1RAB9ALTA4H
SCHEMBL8037867 0.88 TSHR (0.57) TSHRTDP1ALDH1A1KDM4EHSD17B10
SCHEMBL8041262 0.87 TSHR (0.64) TSHRTDP1ALDH1A1KDM4EHSD17B10
SCHEMBL8027769 0.86 ALDH1A1 (0.53) TSHRTDP1ALDH1A1KDM4EHSD17B10
SCHEMBL8039720 0.86 TSHR (0.67) TSHRTDP1ALDH1A1KDM4EHSD17B10
SCHEMBL8037877 0.85 TSHR (0.59) TSHRTDP1ALDH1A1KDM4EHSD17B10
SCHEMBL8041190 0.84 TSHR (0.53) TSHRTDP1ALDH1A1KDM4EHSD17B10
SCHEMBL8044221 0.83 MAPT (0.55) TSHRTDP1ALDH1A1KDM4EHSD17B10
SCHEMBL8027785 0.81 MRGPRX4 (0.48) TSHRTDP1KDM4ESMN1; SMN2LTA4H
SCHEMBL8041209 0.81 LNPEP (0.44) TSHRTDP1ALDH1A1KDM4EGAA

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
EP-0806412-B1 BENZENE DERIVATIVES TEIJIN LTD (JP) 2000-04-05 EP disclosed
US-5808144-A ANTIALLERGENS TEIJIN LIMITED (JP) 1998-09-15 US disclosed
EP-0806412-A1 BENZENE DERIVATIVES TEIJIN LIMITED (JP) 1997-11-12 EP disclosed