SCHEMBL5376400

SCHEMBL5376400

CCCCC(CC)COc1ccccc1NC(=O)C(=O)OCC

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.50
CA2 P00918 1/20 0.50
CYP3A4 P08684 1/20 0.50
GPR35 Q9HC97 1/20 0.49
GAA P10253 4/20 0.48
L3MBTL1 Q9Y468 3/20 0.48
LMNA P02545 2/20 0.46
KMT2A Q03164 2/20 0.46
KDM4E B2RXH2 2/20 0.46
MYC P01106 1/20 0.46
MAX P61244 1/20 0.46
PRSS1 P07477 1/20 0.45
PRSS2 P07478 1/20 0.45
PRSS3 P35030 1/20 0.45
MAPK1 P28482 1/20 0.44
TDP1 Q9NUW8 1/20 0.42
HPGD P15428 1/20 0.42
POLB P06746 1/20 0.42

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
SCHEMBL5396585 0.80 ALDH1A1 (0.55) ALDH1A1CA2CYP3A4LMNAKMT2A
SCHEMBL9408833 0.79 GAA (0.67) ALDH1A1GPR35GAAL3MBTL1LMNA
SCHEMBL10882965 0.79 ALDH1A1 (0.47) ALDH1A1CA2CYP3A4L3MBTL1LMNA
SCHEMBL28685174 0.78 ALDH1A1 (0.69) ALDH1A1CA2CYP3A4L3MBTL1LMNA
SCHEMBL11118978 0.78 RAB9A (0.58) LMNAKMT2AKDM4EMAPK1TDP1
SCHEMBL5145688 0.77 ALDH1A1 (0.46) ALDH1A1CA2CYP3A4L3MBTL1LMNA
SCHEMBL5145684 0.77 ALDH1A1 (0.46) ALDH1A1CA2CYP3A4GAAL3MBTL1
SCHEMBL1777606 0.76 ALDH1A1 (0.55) ALDH1A1CA2CYP3A4L3MBTL1LMNA
SCHEMBL28295778 0.76 ALDH1A1 (0.62) ALDH1A1CA2CYP3A4LMNAKMT2A
SCHEMBL30785986 0.76 GAA (0.74) ALDH1A1GPR35GAAL3MBTL1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7244776-B2 Ultraviolet light absorbers CIBA SPECIALTY CHEMICALS CORPORATION (US) 2007-07-17 US disclosed
US-20070100031-A1 Ultraviolet light absorbers RAVICHANDRAN RAMANATHAN 2007-05-03 US disclosed
US-7173128-B2 Ultraviolet light absorbers CIBA SPECIALTY CHEMICALS CORPORATION (US) 2007-02-06 US disclosed
US-20040192684-A1 Ultraviolet light absorbers CIBA SPECIALTY CHEMICALS CORPORATION 2004-09-30 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-20040192684-A1 Ultraviolet light absorbers UNG, MSH6, MAL2 ALDH1A1 131/4885CA2 2846/4885CYP3A4 39/4885

“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.