SCHEMBL4034059

SCHEMBL4034059

COc1cc(OC)cc(C(Cc2ccc(C(C)(C)C)cc2)C(N)=O)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
NPC1 O15118 1/20 0.44
EPHX2 P34913 1/20 0.44
RAB9A P51151 1/20 0.44
NR1H4 Q96RI1 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
EPHX1 P07099 7/20 0.43
ALDH1A1 P00352 3/20 0.43
LMNA P02545 2/20 0.43
ALOX15 P16050 1/20 0.43
APEX1 P27695 1/20 0.43
MAPK1 P28482 1/20 0.43
RECQL P46063 1/20 0.43
HSD17B10 Q99714 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
MAPT P10636 1/20 0.40
LDHA P00338 1/20 0.40
CCR9 P51686 1/20 0.40
CACNA1I Q9P0X4 1/20 0.40

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
SCHEMBL5177355 0.89 L3MBTL1 (0.49) MEN1KMT2ANPC1EPHX2RAB9A
SCHEMBL4152962 0.88 MEN1 (0.51) MEN1KMT2ANPC1EPHX2RAB9A
SCHEMBL28605298 0.83 EPHX1 (0.64) MEN1KMT2AL3MBTL1EPHX1ALDH1A1
SCHEMBL3945921 0.83 MEN1 (0.47) MEN1KMT2AEPHX1ALOX15LDHA
SCHEMBL5177570 0.81 EPHX1 (0.45) MEN1KMT2AEPHX2NR1H4L3MBTL1
SCHEMBL3272981 0.79 EPHX1 (0.45) MEN1KMT2AL3MBTL1EPHX1ALDH1A1
SCHEMBL5175952 0.79 NR4A1 (0.46) MEN1KMT2AEPHX2NR1H4EPHX1
SCHEMBL3272260 0.78 TRPM8 (0.45) EPHX2NR1H4EPHX1
SCHEMBL3586131 0.78 EPHX1 (0.49) MEN1KMT2AEPHX1ALDH1A1LMNA
SCHEMBL4027743 0.78 ESR1 (0.58) EPHX1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090171091-A1 COMPOUNDS SUITABLE AS MODULATORS OF HDL CADILA HEALTHCARE LIMITED (IN) 2009-07-02 US claimed
US-20090171091-A1 COMPOUNDS SUITABLE AS MODULATORS OF HDL CADILA HEALTHCARE LIMITED (IN) 2009-07-02 US disclosed
EP-2049493-A2 COMPOUNDS SUITABLE AS MODULATORS OF HDL Cadila Healthcare Limited (IN) 2009-04-22 EP disclosed
WO-2008059513-A2 COMPOUNDS SUITABLE AS MODULATORS OF HDL CADILA HEALTHCARE LIMITED (IN) 2008-05-22 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-20090171091-A1 COMPOUNDS SUITABLE AS MODULATORS OF HDL CETP, APOB, HDLBP MEN1 1778/4885KMT2A 4396/4885NPC1 11/4885

“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.