SCHEMBL16489204

SCHEMBL16489204

COCCCNC(=O)CCC(=O)OCc1ccccc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.69
KDM4E B2RXH2 4/20 0.69
MEN1 O00255 4/20 0.60
KMT2A Q03164 4/20 0.60
HPGD P15428 3/20 0.60
TSHR P16473 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.52
ALDH1A1 P00352 3/20 0.52
HTT P42858 1/20 0.50
TAAR1 Q96RJ0 1/20 0.50
POLB P06746 2/20 0.49
TDP1 Q9NUW8 1/20 0.49
NPC1 O15118 1/20 0.48
MAPT P10636 1/20 0.48
CYP2C19 P33261 1/20 0.47
HDAC3 O15379 1/20 0.47
HDAC4 P56524 1/20 0.47
HDAC1 Q13547 1/20 0.47
HDAC7 Q8WUI4 1/20 0.47
HDAC2 Q92769 1/20 0.47

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
SCHEMBL14788798 0.93 LMNA (0.60) LMNAKDM4EMEN1KMT2AHPGD
SCHEMBL16589855 0.87 LMNA (0.58) LMNAKDM4EMEN1KMT2AHPGD
SCHEMBL11957306 0.86 HPGD (0.59) LMNAKDM4EMEN1KMT2AHPGD
SCHEMBL21168984 0.83 ALDH1A1 (0.56) LMNAKDM4EMEN1KMT2AHPGD
SCHEMBL29523215 0.83 LMNA (0.56) LMNAKDM4EMEN1KMT2AHPGD
SCHEMBL15784537 0.83 LMNA (0.54) LMNAKDM4EMEN1KMT2AHPGD
SCHEMBL22166825 0.82 HTT (0.68) LMNAKDM4EMEN1KMT2AHPGD
SCHEMBL20151955 0.82 SMN1; SMN2 (0.53) LMNAKDM4EMEN1KMT2AHPGD
SCHEMBL17767806 0.81 EPHX2 (0.61) LMNAMEN1KMT2AHPGDTSHR
SCHEMBL12409525 0.81 HTT (0.62) LMNAMEN1KMT2AL3MBTL1ALDH1A1

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-9114177-B2 Block copolymer having phenylboronic acid group introduced therein, and use thereof THE UNIVERSITY OF TOKYO (JP) 2015-08-25 US disclosed
US-20150051347-A1 BLOCK COPOLYMER HAVING PHENYLBORONIC ACID GROUP INTRODUCED THEREIN, AND USE THEREOF THE UNIVERSITY OF TOKYO (JP) 2015-02-19 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-20150051347-A1 BLOCK COPOLYMER HAVING PHENYLBORONIC ACID GROUP INTRODUCED THEREIN, AND USE THEREOF SLC1A5, BPGM, BDKRB1 LMNA 2273/4885KDM4E 2428/4885MEN1 1904/4885

“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.