SCHEMBL13461375

SCHEMBL13461375

CC(=O)Oc1ccc2c(c1)Oc1cc(OC(C)=O)ccc1C2(OCO)c1cc(C(=O)NCCOCCOCCCCCCCl)ccc1C

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.39
▸ L3MBTL1 Q9Y468 2/20 0.39
▸ HPGD P15428 3/20 0.38
▸ NPC1 O15118 7/20 0.38
▸ RAB9A P51151 6/20 0.38
▸ GSTP1 P09211 1/20 0.36
▸ HTT P42858 3/20 0.35
▸ SMN1; SMN2 Q16637 3/20 0.35
▸ LMNA P02545 3/20 0.34
▸ POLB P06746 1/20 0.34
▸ MAPT P10636 2/20 0.33
▸ MEN1 O00255 2/20 0.33
▸ USP2 O75604 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ PKM P14618 1/20 0.33
▸ GAA P10253 1/20 0.32
▸ OPRM1 P35372 1/20 0.32
▸ SMPD1 P17405 1/20 0.31

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
SCHEMBL14330482 0.87 HDAC3 (0.33) KMT2AHPGDSMN1; SMN2LMNAPOLB
SCHEMBL16503905 0.82 LMNA (0.33) KMT2AHPGDSMN1; SMN2LMNAPOLB
SCHEMBL13435046 0.81 KMT2A (0.53) KMT2AL3MBTL1HPGDNPC1RAB9A
SCHEMBL31343967 0.80 GSTP1 (0.58) KMT2AL3MBTL1HPGDNPC1RAB9A
SCHEMBL15976894 0.71 HDAC3 (0.33) KMT2AL3MBTL1HPGDSMN1; SMN2MAPT
SCHEMBL4437789 0.71 HPGD (0.40) KMT2AL3MBTL1HPGDNPC1RAB9A
SCHEMBL12951612 0.71 GSTP1 (0.42) KMT2AHPGDGSTP1HTTLMNA
SCHEMBL12018901 0.71 HDAC6 (0.34) KMT2AL3MBTL1NPC1RAB9ASMN1; SMN2
SCHEMBL4437792 0.70 GSTP1 (0.59) KMT2ANPC1RAB9AGSTP1HTT
SCHEMBL4403233 0.69 GSTP1 (0.41) KMT2AGSTP1HTTLMNAMAPT

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-20100075394-A1 Method of Crosslinking Two Objects of Interest ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (CH) 2010-03-25 — — 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-20100075394-A1 Method of Crosslinking Two Objects of Interest CD2BP2, FYN, ILK KMT2A 3466/4885L3MBTL1 2203/4885HPGD 3489/4885

“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.

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