SCHEMBL2992702

SCHEMBL2992702

CCOP(=O)(OCC)c1cc2c(OC(C)=O)c(c1)Cc1cc(P(=O)(OCC)OCC)cc(c1OC(C)=O)Cc1cc(P(=O)(OCC)OCC)cc(c1OC(C)=O)Cc1cc(P(=O)(OCC)OCC)cc(c1OC(C)=O)Cc1cc(P(=O)(OCC)OCC)cc(c1OC(C)=O)Cc1cc(P(=O)(OCC)OCC)cc(c1OC(C)=O)C2

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.34
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ HDAC1 Q13547 1/20 0.32
▸ MAPT P10636 2/20 0.31
▸ TOP1 P11387 2/20 0.31
▸ ELANE P08246 1/20 0.31
▸ CD69 Q07108 1/20 0.31
▸ LMNA P02545 2/20 0.31
▸ HTT P42858 2/20 0.31
▸ ALOX5 P09917 2/20 0.31
▸ L3MBTL1 Q9Y468 2/20 0.31
▸ S1PR2 O95136 1/20 0.31
▸ TP53 P04637 1/20 0.31
▸ HSP90AA1 P07900 1/20 0.31
▸ HSP90AB1 P08238 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ THRB P10828 1/20 0.31
▸ ALOX15 P16050 1/20 0.31
▸ MAPK1 P28482 1/20 0.31

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
SCHEMBL2990792 1.00 POLB (0.34) POLBMEN1KMT2AHDAC1MAPT
SCHEMBL2986985 0.79 PTPRB (0.44) POLBMEN1KMT2ACD69ACHE
SCHEMBL2990563 0.79 PTPRB (0.44) POLBMEN1KMT2ACD69ACHE
SCHEMBL12012728 0.77 HTT (0.36) POLBMEN1KMT2AMAPTLMNA
SCHEMBL6067643 0.76 GSTA1 (0.44) —
SCHEMBL12012734 0.71 LMNA (0.48) POLBMEN1KMT2AMAPTELANE
SCHEMBL9276839 0.71 LMNA (0.42) POLBMAPTTOP1ELANECD69
SCHEMBL2984853 0.70 CFD (0.38) POLBMAPTTOP1ELANECD69
SCHEMBL11873114 0.67 CYP2C9 (0.41) POLBMEN1KMT2AHDAC1MAPT
SCHEMBL2534198 0.65 TSHR (0.40) POLBMEN1KMT2ATP53GAA

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-8252954-B2 Processes for the preparation of calixarene derivatives THE CURATORS OF THE UNIVERSITY OF MISSOURI (US) 2012-08-28 — — US disclosed
US-20100185022-A1 PROCESSES FOR THE PREPARATION OF CALIXARENE DERIVATIVES THE UNIVERSITY OF WESTERN AUSTRALIA (AU) 2010-07-22 — — 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-20100185022-A1 PROCESSES FOR THE PREPARATION OF CALIXARENE DERIVATIVES CALD1, CANX, CALU POLB 1227/4885MEN1 4093/4885KMT2A 4773/4885

“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.

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