SCHEMBL972874

SCHEMBL972874

O=C1c2cccc(OCc3ccccc3)c2C(=O)c2c(OCc3ccccc3)cc(CO)cc21

nearest known ligand 0.71

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.52
MAOA P21397 1/20 0.52
MAOB P27338 1/20 0.52
EPHX2 P34913 1/20 0.52
KMT2A Q03164 1/20 0.52
KCNA3 P22001 1/20 0.45
ELANE P08246 1/20 0.44
PTGER1 P34995 2/20 0.43
PTGER4 P35408 1/20 0.43
PTGER3 P43115 1/20 0.43
PTGER2 P43116 1/20 0.43
RXRA P19793 1/20 0.42
RXRB P28702 1/20 0.42
RXRG P48443 1/20 0.42
TTR P02766 1/20 0.42
SLC37A4 O43826 1/20 0.42

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
SCHEMBL9173435 0.86 KCNA3 (0.56) MAOBKCNA3ELANEPTGER1PTGER4
SCHEMBL971641 0.84 KMT2A (0.60) MEN1KMT2APTGER1RXRARXRB
SCHEMBL16919801 0.83 KCNA3 (0.46) MAOBKCNA3ELANEPTGER1PTGER4
SCHEMBL9754264 0.82 KCNA3 (0.63) MAOBKMT2AKCNA3ELANEPTGER1
SCHEMBL16072720 0.82 KCNA3 (0.58) MAOBKCNA3PTGER1PTGER4PTGER3
SCHEMBL28458919 0.81 SMN1; SMN2 (0.49) MEN1KMT2AKCNA3PTGER1PTGER4
SCHEMBL16919799 0.81 MAPT (0.57) MEN1KMT2APTGER1PTGER4PTGER3
SCHEMBL8996370 0.79 EGFR (0.58) MEN1MAOAMAOBEPHX2KMT2A
SCHEMBL21657907 0.77 ALDH1A1 (0.44) MEN1KMT2APTGER1PTGER4PTGER3
SCHEMBL21657912 0.77 MEN1 (0.45) MEN1KMT2APTGER1PTGER4PTGER3

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-8324411-B2 Process for the preparation of DIACEREIN LABORATORIO CHIMICO INTERNAZIONALE S.P.A. (IT) 2012-12-04 US disclosed
US-20110015269-A1 PROCESS FOR THE PREPARATION OF DIACERIN LABORATORIO CHIMICO INTERNAZIONALE S.P.A. (IT) 2011-01-20 US disclosed
EP-2234953-A1 PROCESS FOR THE PREPARATION OF DIACERIN Laboratorio Chimico Internazionale S.p.A. (IT) 2010-10-06 EP disclosed
WO-2009090483-A1 PROCESS FOR THE PREPARATION OF DIACERIN LABORATORIO CHIMICO INTERNAZIONALE S.P.A. (IT) 2009-07-23 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-20110015269-A1 PROCESS FOR THE PREPARATION OF DIACERIN ALOX15B, ALOX12, ACAT1 MEN1 1265/4885MAOA 630/4885MAOB 1022/4885

“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.