SCHEMBL211114

SCHEMBL211114

COc1cc(Cc2cc(CO)c(O)c(OC)c2)cc(CO)c1O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SHBG P04278 1/20 0.58
TNKS2 Q9H2K2 1/20 0.47
PDE4A P27815 2/20 0.47
PDE4B Q07343 2/20 0.47
PDE4C Q08493 2/20 0.47
PDE4D Q08499 2/20 0.47
CALM1 P0DP23 2/20 0.46
TUBB4A P04350 1/20 0.45
TUBB P07437 1/20 0.45
TUBA3C P0DPH7 1/20 0.45
TUBA1B P68363 1/20 0.45
TUBA4A P68366 1/20 0.45
TUBB4B P68371 1/20 0.45
TUBB3 Q13509 1/20 0.45
TUBB2A Q13885 1/20 0.45
TUBB8 Q3ZCM7 1/20 0.45
TUBA3E Q6PEY2 1/20 0.45
TUBA1A Q71U36 1/20 0.45
TUBA1C Q9BQE3 1/20 0.45
TUBB6 Q9BUF5 1/20 0.45

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
SCHEMBL14606346 0.98 SHBG (0.56) SHBGTNKS2PDE4APDE4BPDE4C
SCHEMBL10130851 0.94 SHBG (0.56) SHBGTNKS2PDE4APDE4BPDE4C
SCHEMBL829369 0.90 KDM4E (0.52) SHBGTNKS2PDE4APDE4BPDE4C
SCHEMBL930805 0.89 TNKS2 (0.56) SHBGTNKS2PDE4APDE4BPDE4C
SCHEMBL10130969 0.88 SHBG (0.74) SHBGTNKS2PDE4APDE4BPDE4C
SCHEMBL10130847 0.87 PTGS2 (0.52) SHBGTNKS2PDE4APDE4BPDE4C
SCHEMBL14159051 0.87 SHBG (0.49) SHBGTNKS2PDE4APDE4BPDE4C
SCHEMBL15221748 0.84 TNKS2 (0.51) SHBGTNKS2PDE4APDE4BPDE4C
SCHEMBL7702890 0.83 AKR1B1 (0.55) TNKS2CALM1TUBB4ATUBBTUBA3C
SCHEMBL18462968 0.83 CALM1 (0.50) SHBGTNKS2CALM1TUBB4ATUBB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE43067-E1 Method for producing new polynuclear poly(formylphenol) HONSHU CHEMICAL INDUSTRY CO., LTD. (JP) 2012-01-03 US disclosed
US-7750190-B2 reacting hexamethylene tetramine in presence of acid; industrial scale; photoresists HONSHU CHEMICAL INDUSTRY CO., LTD. (JP) 2010-07-06 US disclosed
US-20090182175-A1 METHOD FOR PRODUCING NEW POLYNUCLEAR POLY(FORMYLPHENOL) HONSHU CHEMICAL INDUSTRY CO., LTD. (JP) 2009-07-16 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-20090182175-A1 METHOD FOR PRODUCING NEW POLYNUCLEAR POLY(FORMYLPHENOL) PCBP1, FPR2, PNKP SHBG 3146/4885TNKS2 266/4885PDE4A 4488/4885

“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.