SCHEMBL3074618

SCHEMBL3074618

CCOC(=O)C(COC1CCCCO1)(COC1CCCCO1)C(=O)OCC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
ALDH1A1 P00352 5/20 0.34
HPGD P15428 3/20 0.34
CREBBP Q92793 1/20 0.33
KDM4E B2RXH2 1/20 0.33
POLB P06746 1/20 0.33
TSHR P16473 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HSD17B10 Q99714 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
TP53 P04637 2/20 0.33
NPC1 O15118 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
RAB9A P51151 1/20 0.33
CYP3A4 P08684 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32

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
SCHEMBL11110959 0.86 MEN1 (0.41) MEN1KMT2AALDH1A1HPGDCREBBP
SCHEMBL9053520 0.85 KMT2A (0.37) MEN1KMT2AALDH1A1HPGDCREBBP
SCHEMBL186143 0.84 MEN1 (0.36) MEN1KMT2AALDH1A1HPGDTP53
SCHEMBL3283171 0.83 MEN1 (0.35) MEN1KMT2ATHRBCYP4F2CYP4A11
SCHEMBL9115989 0.80 MEN1 (0.40) MEN1KMT2AALDH1A1CREBBPKDM4E
SCHEMBL11114764 0.79 MEN1 (0.42) MEN1KMT2AALDH1A1HPGDCREBBP
SCHEMBL10197050 0.79 MEN1 (0.32) MEN1KMT2ATHRBCYP4F2CYP4A11
SCHEMBL374442 0.78 KMT2A (0.44) MEN1KMT2AALDH1A1HPGDCREBBP
SCHEMBL12336899 0.77 MEN1 (0.41) MEN1KMT2AALDH1A1HPGDCREBBP
SCHEMBL11109111 0.77 MEN1 (0.44) MEN1KMT2AALDH1A1CREBBPKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2222740-B1 FUNCTIONALIZED PHOTOREACTIVE COMPOUNDS ROLIC AG (CH) 2017-10-11 EP disclosed
EP-2222740-B1 FUNCTIONALIZED PHOTOREACTIVE COMPOUNDS ROLIC AG (CH) 2017-10-11 EP disclosed
US-9499649-B2 Functionalized photoreactive compounds ROLIC AG (CH) 2016-11-22 US disclosed
US-9499649-B2 Functionalized photoreactive compounds ROLIC AG (CH) 2016-11-22 US disclosed
US-9499649-B2 Functionalized photoreactive compounds ROLIC AG (CH) 2016-11-22 US disclosed
US-20100266821-A1 FUNCTIONALIZED PHOTOREACTIVE COMPOUNDS ROLIC AG (CH) 2010-10-21 US disclosed
US-20100266821-A1 FUNCTIONALIZED PHOTOREACTIVE COMPOUNDS ROLIC AG (CH) 2010-10-21 US disclosed
US-20100266821-A1 FUNCTIONALIZED PHOTOREACTIVE COMPOUNDS ROLIC AG (CH) 2010-10-21 US disclosed
EP-2222740-A1 FUNCTIONALIZED PHOTOREACTIVE COMPOUNDS Rolic AG (CH) 2010-09-01 EP disclosed
WO-2009080147-A1 FUNCTIONALIZED PHOTOREACTIVE COMPOUNDS ROLIC AG (CH) 2009-07-02 WO disclosed
WO-2009080147-A1 FUNCTIONALIZED PHOTOREACTIVE COMPOUNDS ROLIC AG (CH) 2009-07-02 WO 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-20100266821-A1 FUNCTIONALIZED PHOTOREACTIVE COMPOUNDS ETV6, TERB1, VCL MEN1 3607/4885KMT2A 1776/4885ALDH1A1 3835/4885

“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.