SCHEMBL18237262

SCHEMBL18237262

COc1ccc2cc(C(=O)OCC(O)COc3ccc(S(=O)(=O)c4ccc(OCC(O)COC(=O)c5ccc6cc(OC)ccc6c5)cc4)cc3)ccc2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 3/20 0.46
ADRB1 P08588 3/20 0.46
ADRB3 P13945 3/20 0.46
LMNA P02545 1/20 0.46
POLB P06746 1/20 0.46
MAPT P10636 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
ALDH1A1 P00352 5/20 0.44
GAA P10253 2/20 0.44
KDM4E B2RXH2 1/20 0.44
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA4 P22748 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42
PLAU P00749 1/20 0.42
CYP1A2 P05177 1/20 0.41
HPGD P15428 1/20 0.41

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
SCHEMBL18234070 0.93 ALDH1A1 (0.44) ADRB2ADRB1ADRB3LMNAPOLB
SCHEMBL19051185 0.85 MEN1 (0.43) ADRB2ADRB1ADRB3LMNAPOLB
SCHEMBL17280573 0.81 ADRB2 (0.53) ADRB2ADRB1ADRB3LMNAPOLB
SCHEMBL17280571 0.81 ADRB2 (0.55) ADRB2ADRB1ADRB3MAPTALDH1A1
SCHEMBL24210354 0.80 MEN1 (0.47) ADRB2ADRB1ADRB3LMNAPOLB
SCHEMBL24210324 0.80 MEN1 (0.43) ADRB2ADRB1ADRB3LMNAPOLB
SCHEMBL12311421 0.79 MEN1 (0.69) ADRB2ADRB1ADRB3LMNAPOLB
SCHEMBL24210576 0.79 SERPINE1 (0.49) LMNAPOLBMAPTNPSR1KMT2A
SCHEMBL12999567 0.78 ADRB2 (0.53) ADRB2ADRB1ADRB3LMNAPOLB
SCHEMBL16661815 0.78 ADRB2 (0.49) ADRB2ADRB1ADRB3LMNAPOLB

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-9728420-B2 Organic film composition, process for forming organic film, patterning process, and compound SHIN-ETSU CHEMICAL CO., LTD. (JP) 2017-08-08 US disclosed
US-20160336189-A1 ORGANIC FILM COMPOSITION, PROCESS FOR FORMING ORGANIC FILM, PATTERNING PROCESS, AND COMPOUND SHIN-ETSU CHEMICAL CO., LTD. (JP) 2016-11-17 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-20160336189-A1 ORGANIC FILM COMPOSITION, PROCESS FOR FORMING ORGANIC FILM, PATTERNING PROCESS, AND COMPOUND CHRM1, CHRM2, POF1B ADRB2 1632/4885ADRB1 1822/4885ADRB3 3349/4885

“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.