SCHEMBL7533434

SCHEMBL7533434

CCCCC(CC)CC(=Cc1ccc(OC)cc1)C(=O)O.CCCCCCCCOC(=O)c1ccccc1O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.52
ALDH1A1 P00352 6/20 0.44
TSHR P16473 5/20 0.44
PRSS1 P07477 1/20 0.44
PRSS2 P07478 1/20 0.44
PRSS3 P35030 1/20 0.44
TDP1 Q9NUW8 4/20 0.43
CYP3A4 P08684 3/20 0.43
CA2 P00918 1/20 0.43
MAPK1 P28482 2/20 0.42
TP53 P04637 1/20 0.42
L3MBTL1 Q9Y468 5/20 0.41
KDM4E B2RXH2 3/20 0.41
HSD17B10 Q99714 2/20 0.41
POLB P06746 2/20 0.41
MAPT P10636 4/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CASP3 P42574 2/20 0.38
SENP8 Q96LD8 2/20 0.38
SENP7 Q9BQF6 2/20 0.38

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
SCHEMBL10437218 0.84 TDP1 (0.45) LMNAALDH1A1PRSS1PRSS2PRSS3
SCHEMBL126604 0.83 TDP1 (0.56) ALDH1A1TDP1CYP3A4CA2MAPT
SCHEMBL5198950 0.83 TDP1 (0.56) ALDH1A1TDP1CYP3A4CA2MAPT
SCHEMBL17627791 0.83 TDP1 (0.56) ALDH1A1TDP1CYP3A4CA2MAPT
SCHEMBL527532 0.82 TDP1 (0.64) LMNATDP1SMN1; SMN2
SCHEMBL5677176 0.81 TDP1 (0.50) TDP1MAPT
SCHEMBL1959631 0.79 TDP1 (0.47) LMNAALDH1A1TDP1CYP3A4CA2
SCHEMBL7528577 0.79 ALDH1A1 (0.45) LMNAALDH1A1TSHRTDP1MAPK1
Anisaldehyde SCHEMBL28325525 0.78 TSHR (0.57) LMNAALDH1A1TSHRTDP1CYP3A4
Cinnamic Acid SCHEMBL16972733 0.78 TDP1 (0.57) LMNAALDH1A1TDP1CYP3A4MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020006913-A1 ANTIMUTAGENIC COMPOSITIONS FOR TREATMENT AND PREVENTION OF PHOTODAMAGE TO SKIN PRO-NEURON, INC. 2002-01-17 US disclosed