SCHEMBL9339702

SCHEMBL9339702

CSc1ccc(C(=O)/C=C/c2ccc(O)cc2O)cc1

nearest known ligand 0.76

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 6/20 0.75
TYR P14679 2/20 0.67
MEN1 O00255 1/20 0.65
ALDH1A1 P00352 1/20 0.65
LMNA P02545 1/20 0.65
GAA P10253 1/20 0.65
MAPT P10636 1/20 0.65
CASP3 P42574 1/20 0.65
RAB9A P51151 1/20 0.65
KMT2A Q03164 1/20 0.65
SENP8 Q96LD8 1/20 0.65
SENP7 Q9BQF6 1/20 0.65
SENP6 Q9GZR1 1/20 0.65
CTSL P07711 1/20 0.55
CTSB P07858 1/20 0.55
TDP1 Q9NUW8 1/20 0.55

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
SCHEMBL9339710 1.00 CHRNA7 (0.75) CHRNA7TYRMEN1ALDH1A1LMNA
SCHEMBL9337637 0.89 ALDH1A1 (0.65) CHRNA7MEN1ALDH1A1LMNAGAA
SCHEMBL9337650 0.89 ALDH1A1 (0.65) CHRNA7MEN1ALDH1A1LMNAGAA
SCHEMBL1695380 0.86 CHRNA7 (1.00) CHRNA7TYRCTSLCTSBTDP1
SCHEMBL21446884 0.86 CHRNA7 (1.00) CHRNA7TYRCTSLCTSBTDP1
SCHEMBL1695381 0.86 CHRNA7 (1.00) CHRNA7TYRCTSLCTSBTDP1
SCHEMBL28606028 0.86 MEN1 (0.62) CHRNA7MEN1ALDH1A1LMNAGAA
SCHEMBL9337678 0.85 MAPT (0.60) CHRNA7MEN1ALDH1A1LMNAGAA
SCHEMBL9337658 0.85 MAPT (0.60) CHRNA7MEN1ALDH1A1LMNAGAA
SCHEMBL9342731 0.84 MAPT (0.59) CHRNA7TYRMEN1ALDH1A1LMNA

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-0328668-B1 NONLINEAR OPTICAL MATERIAL NIPPON OILS & FATS CO LTD (JP) 1994-05-25 EP disclosed
US-5045239-A Chalcone derivative NIPPON OIL AND FATS CO., LTD. (JP) 1991-09-03 US disclosed
EP-0328668-A1 NONLINEAR OPTICAL MATERIAL NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1989-08-23 EP disclosed