SCHEMBL6540352

SCHEMBL6540352

O=C(O)N(Cc1ccccc1)[C@H](CO)Cc1ccc(I)cc1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
FPR2 P25090 3/20 0.41
HPGD P15428 1/20 0.40
CYP1A2 P05177 1/20 0.39
PTPN1 P18031 1/20 0.38
ALOX5 P09917 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
POLB P06746 1/20 0.38
HSD17B10 Q99714 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
SIGMAR1 Q99720 2/20 0.37

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
SCHEMBL9012916 0.91 MEN1 (0.49) MEN1KMT2AHPGDCYP1A2ALDH1A1
SCHEMBL6539436 0.85 BACE1 (0.45) MEN1KMT2AHPGDALDH1A1LMNA
SCHEMBL6540317 0.79 TAS2R14 (0.50) MEN1KMT2AL3MBTL1
SCHEMBL2268145 0.76 MEN1 (0.47) MEN1KMT2AHPGDCYP1A2ALDH1A1
SCHEMBL1024207 0.76 KMT2A (0.47) MEN1KMT2AHPGDCYP1A2ALDH1A1
SCHEMBL18341181 0.76 KMT2A (0.47) MEN1KMT2AHPGDCYP1A2ALDH1A1
SCHEMBL1642165 0.76 KMT2A (0.51) MEN1KMT2AHPGDALDH1A1LMNA
SCHEMBL18341183 0.76 KMT2A (0.47) MEN1KMT2AHPGDCYP1A2ALDH1A1
Hydrochloric Acid SCHEMBL20974171 0.75 KMT2A (0.46) MEN1KMT2AHPGDCYP1A2ALDH1A1
Hydrochloric Acid SCHEMBL20974172 0.75 KMT2A (0.46) MEN1KMT2AHPGDCYP1A2ALDH1A1

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-20040138462-A1 Aminoalcohol derivatives ASTELLAS PHARMA INC. (JP) 2004-07-15 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-20040138462-A1 Aminoalcohol derivatives BPHL, FANCD2, HRH2 MEN1 4140/4885KMT2A 432/4885FPR2 627/4885

“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.