SCHEMBL4247248

SCHEMBL4247248

CCCCCCCCCCCCCCCCC(C(=O)O)c1ccc2c(C)cc(=O)oc2c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 0.48
KDM4E B2RXH2 9/20 0.48
HPGD P15428 7/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
CASP3 P42574 1/20 0.48
SENP8 Q96LD8 1/20 0.48
SENP7 Q9BQF6 1/20 0.48
SENP6 Q9GZR1 1/20 0.48
GLA P06280 5/20 0.48
GAA P10253 4/20 0.48
KMT2A Q03164 2/20 0.48
IGLV6-57 P01721 6/20 0.47
HSD17B10 Q99714 5/20 0.46
CASP1 P29466 2/20 0.46
CASP7 P55210 2/20 0.46
CA12 O43570 2/20 0.46
LMNA P02545 2/20 0.46
CA9 Q16790 2/20 0.46

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
SCHEMBL3952916 0.94 ALDH1A1 (0.44) ALDH1A1KDM4EHPGDSMN1; SMN2NPC1
SCHEMBL3958792 0.76 NDUFS8 (0.45) ALDH1A1KDM4ECA12CA9MAOB
SCHEMBL20581664 0.75 FPR1 (0.39) ALDH1A1KDM4EGLAGAAKMT2A
SCHEMBL28382736 0.75 FPR1 (0.39) ALDH1A1KDM4EGLAGAAKMT2A
SCHEMBL8602180 0.74 LMNA (0.37) LMNA
Palmitic Acid SCHEMBL5886483 0.74 ALDH1A1 (0.66) ALDH1A1KDM4EHPGDSMN1; SMN2NPC1
SCHEMBL16406163 0.73 ALDH1A1 (0.56) ALDH1A1KDM4EHPGDSMN1; SMN2NPC1
SCHEMBL9938570 0.72 LMNA (0.49) ALDH1A1SMN1; SMN2LMNAL3MBTL1
SCHEMBL12386901 0.72 IGLV6-57 (0.60) ALDH1A1KDM4EHPGDSMN1; SMN2NPC1
SCHEMBL31489975 0.71 AKR1C3 (0.47) ALDH1A1SMN1; SMN2LMNA

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-20090104711-A1 FLUORESCENT MARKER COMPRISING DOUBLE BOND ESTER GROUP AND METHOD FOR MARKING AND DETECTING THE SAME SIM HYUN-HO 2009-04-23 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090104711-A1 FLUORESCENT MARKER COMPRISING DOUBLE BOND ESTER GROUP AND METHOD FOR MARKING AND DETECTING THE SAME ELOVL1, FASN, ELOVL5 ALDH1A1 270/4885KDM4E 4257/4885HPGD 196/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.