SCHEMBL14619944

SCHEMBL14619944

CCOC(=O)CCCCCN(CCCS(=O)(=O)O)c1ccc(CC(=O)O)cc1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.42
MAPK1 P28482 1/20 0.42
KMT2A Q03164 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
CYP4Z1 Q86W10 3/20 0.39
CNR2 P34972 3/20 0.39
ALOX5 P09917 1/20 0.38
CYP4F11 Q9HBI6 1/20 0.38
CYP4F12 Q9HCS2 1/20 0.38
LTA4H P09960 3/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NR3C1 P04150 1/20 0.36
CYP4F2 P78329 1/20 0.35
CYP4A11 Q02928 1/20 0.35

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
SCHEMBL13086504 0.83 SMN1; SMN2 (0.43) ALDH1A1MAPK1KMT2ATDP1CNR2
SCHEMBL2761731 0.83 SMN1; SMN2 (0.52) ALDH1A1MAPK1KMT2ATDP1ALOX5
SCHEMBL11854270 0.81 SMN1; SMN2 (0.48) ALDH1A1CYP4Z1CNR2ALOX5CYP4F11
SCHEMBL14588470 0.80 CYP4Z1 (0.38) ALDH1A1MAPK1KMT2ATDP1CYP4Z1
SCHEMBL19347237 0.78 ALDH1A1 (0.41) ALDH1A1MAPK1KMT2ATDP1ALOX5
SCHEMBL19347247 0.78 KDM4E (0.41) ALDH1A1MAPK1KMT2ATDP1CYP4Z1
SCHEMBL2762099 0.76 SMN1; SMN2 (0.45) ALDH1A1MAPK1KMT2ATDP1ALOX5
SCHEMBL14496299 0.74 ALDH1A1 (0.60) ALDH1A1CNR2NR3C1
SCHEMBL13084296 0.74 ALOX5 (0.34) ALDH1A1MAPK1KMT2ATDP1ALOX5
SCHEMBL15457594 0.73 ALOX5 (0.34) ALDH1A1MAPK1KMT2ATDP1ALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7161010-B2 Methine dyes; coloring compound FUJI PHOTO FILM CO., LTD. (JP) 2007-01-09 US disclosed
US-20070004923-A1 Methine compound and silver halide photographic material containing the same FUJI PHOTO FILM CO., LTD. 2007-01-04 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-20070004923-A1 Methine compound and silver halide photographic material containing the same PYM1, NPM1, METTL3 ALDH1A1 172/4885MAPK1 1391/4885KMT2A 96/4885

“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.