SCHEMBL12326366

SCHEMBL12326366

O=C(CCCO)C1CC2C=CC1C2

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.49
LMNA P02545 1/20 0.49
EPHX2 P34913 4/20 0.38
ALDH1A1 P00352 4/20 0.36
RAB9A P51151 1/20 0.36
KMT2A Q03164 2/20 0.34
HSD17B10 Q99714 2/20 0.33
USP2 O75604 1/20 0.33
TSHR P16473 1/20 0.33
HTT P42858 1/20 0.33
THRB P10828 1/20 0.33
POLB P06746 2/20 0.33
APEX1 P27695 1/20 0.33
RECQL P46063 1/20 0.33
BLM P54132 1/20 0.33
ESR2 Q92731 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
HPGD P15428 1/20 0.33
ESR1 P03372 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
SCHEMBL13346339 0.84 LMNA (0.47) KDM4ELMNAEPHX2ALDH1A1RAB9A
SCHEMBL8852595 0.84 LMNA (0.47) KDM4ELMNAEPHX2ALDH1A1RAB9A
SCHEMBL32688754 0.83 KDM4E (0.46) KDM4ELMNAEPHX2ALDH1A1RAB9A
SCHEMBL17165985 0.83 KDM4E (0.46) KDM4ELMNAEPHX2ALDH1A1RAB9A
SCHEMBL17165983 0.81 KDM4E (0.45) KDM4ELMNAEPHX2ALDH1A1KMT2A
Oxybate SCHEMBL7674808 0.81 CAMK2A (0.45) KDM4ELMNAEPHX2ALDH1A1RAB9A
SCHEMBL11706113 0.80 KDM4E (0.44) KDM4ELMNAEPHX2ALDH1A1RAB9A
SCHEMBL13346338 0.80 KDM4E (0.50) KDM4ELMNAEPHX2ALDH1A1RAB9A
SCHEMBL8852518 0.79 KDM4E (0.46) KDM4ELMNAEPHX2ALDH1A1RAB9A
SCHEMBL14581091 0.79 KDM4E (0.62) KDM4ELMNAEPHX2ALDH1A1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2078028-B1 PHOTOACTIVE COMPOUNDS AZ ELECTRONIC MATERIALS USA (US) 2011-09-07 EP disclosed
WO-2010064135-A2 A PHOTOSENSITIVE COMPOSITION AZ ELECTRONIC MATERIALS USA CORP. (US) 2010-06-10 WO disclosed
US-20100099906-A1 GENERATION OF ENDO- AND/OR EXO-NORBORNENECARBOXALDEHYDE AS AN INTERMEDIATE TO FUNCTIONALIZED NORBORNENES PROMERUS LLC (US) 2010-04-22 US disclosed
US-7700262-B2 Top coat material and use thereof in lithography processes INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2010-04-20 US disclosed
US-20080166568-A1 TOP COAT MATERIAL AND USE THEREOF IN LITHOGRAPHY PROCESSES INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2008-07-10 US disclosed
WO-2008041123-A1 PHOTOACTIVE COMPOUNDS AZ ELECTRONIC MATERIALS USA CORP. (DE) 2008-04-10 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-20100099906-A1 GENERATION OF ENDO- AND/OR EXO-NORBORNENECARBOXALDEHYDE AS AN INTERMEDIATE TO FUNCTIONALIZED NORBORNENES GNE, GALE, EXOSC5 KDM4E 2962/4885LMNA 1713/4885EPHX2 301/4885

“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.