SCHEMBL23623780

SCHEMBL23623780

CC(C)(C)C(/N=C/c1ccccc1O)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.49
HPGD P15428 4/20 0.46
MAPT P10636 3/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
GAA P10253 2/20 0.46
CTRC Q99895 1/20 0.46
DUSP3 P51452 1/20 0.46
PTPN5 P54829 1/20 0.46
PTPN11 Q06124 1/20 0.46
GFER P55789 1/20 0.46
KDM4E B2RXH2 4/20 0.44
HSD17B10 Q99714 2/20 0.44
TDP1 Q9NUW8 2/20 0.44
USP2 O75604 1/20 0.44
POLB P06746 1/20 0.44
ALOX15 P16050 1/20 0.44
ALOX12 P18054 1/20 0.44
RECQL P46063 1/20 0.44
TSHR P16473 1/20 0.44

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
SCHEMBL11353080 0.81 ALDH1A1 (0.49) ALDH1A1HPGDMAPTMEN1KMT2A
SCHEMBL11351501 0.81 ALDH1A1 (0.49) ALDH1A1HPGDMAPTMEN1KMT2A
SCHEMBL11348179 0.81 ALDH1A1 (0.49) ALDH1A1HPGDMAPTMEN1KMT2A
SCHEMBL10624960 0.81 ALDH1A1 (0.49) ALDH1A1HPGDMAPTMEN1KMT2A
SCHEMBL10624968 0.81 ALDH1A1 (0.49) ALDH1A1HPGDMAPTMEN1KMT2A
SCHEMBL13091080 0.78 KDM4E (0.31) ALDH1A1HPGDMAPTGAAKDM4E
SCHEMBL7825430 0.75 ALDH1A1 (0.58) ALDH1A1HPGDMAPTMEN1KMT2A
SCHEMBL7825434 0.75 ALDH1A1 (0.58) ALDH1A1HPGDMAPTMEN1KMT2A
SCHEMBL7825432 0.75 ALDH1A1 (0.58) ALDH1A1HPGDMAPTMEN1KMT2A
SCHEMBL10049948 0.75 ALDH1A1 (0.52) ALDH1A1HPGDMAPTMEN1KMT2A

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-11407692-B2 Method for oxidative cleavage of compounds with unsaturated double bond NATIONAL TSING HUA UNIVERSITY (TW) 2022-08-09 US disclosed
US-20210206702-A1 METHOD FOR OXIDATIVE CLEAVAGE OF COMPOUNDS WITH UNSATURATED DOUBLE BOND NATIONAL TSING HUA UNIVERSITY (TW) 2021-07-08 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 (2 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-11407692-B2 Method for oxidative cleavage of compounds with unsaturated double bond ALOX12, ALOX15, DUOX1 ALDH1A1 509/4885HPGD 1048/4885MAPT 4464/4885
US-20210206702-A1 METHOD FOR OXIDATIVE CLEAVAGE OF COMPOUNDS WITH UNSATURATED DOUBLE BOND ALOX12, ALOX15, DUOX1 ALDH1A1 509/4885HPGD 1048/4885MAPT 4464/4885

“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.