SCHEMBL5019472

SCHEMBL5019472

Cc1ccc(C(=O)Oc2ccc(/C=C/C(=O)OCc3cc(N)ccc3-c3ccc(N)cc3COC(=O)/C=C/c3ccc(OC(=O)c4ccc(C)cc4)cc3)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.45
KDM4E B2RXH2 1/20 0.45
KMT2A Q03164 3/20 0.43
MAOB P27338 3/20 0.41
MAOA P21397 2/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
CA14 Q9ULX7 1/20 0.41
PRSS1 P07477 1/20 0.40
ACR P10323 1/20 0.40
LMNA P02545 2/20 0.39
ALDH1A1 P00352 1/20 0.39
MAPK1 P28482 1/20 0.39
POLB P06746 1/20 0.38
RAB9A P51151 1/20 0.38
MEN1 O00255 1/20 0.38
MET P08581 1/20 0.38

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
SCHEMBL679772 0.91 MAPT (0.44) MAPTKDM4EKMT2AMAOBMAOA
SCHEMBL679197 0.91 MAPT (0.44) MAPTKDM4EKMT2AMAOBMAOA
SCHEMBL13495601 0.86 CYP19A1 (0.51) MAPTKDM4EKMT2ACA12CA1
SCHEMBL679884 0.85 MAPT (0.46) MAPTKDM4EKMT2AMAOBMAOA
SCHEMBL679321 0.85 MAPT (0.46) MAPTKDM4EKMT2AMAOBMAOA
SCHEMBL679372 0.84 ABCG2 (0.40) MAPTKDM4EMAOBCA12CA1
SCHEMBL30086264 0.84 ABCG2 (0.40) MAPTKDM4EMAOBCA12CA1
SCHEMBL18112629 0.84 ABCG2 (0.40) MAPTKDM4EMAOBCA12CA1
SCHEMBL14854050 0.83 CYSLTR1 (0.38) MAPTKDM4ECA12CA1CA7
SCHEMBL3610591 0.82 MAPT (0.47) MAPTKDM4EKMT2ALMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180079961-A1 PHOTOALIGNMENT COMPOSITION ROLIC AG (CH) 2018-03-22 US disclosed
US-8557922-B2 Photocrosslinkable materials ROLIC AG (CH) 2013-10-15 US disclosed
US-8329823-B2 Photocrosslinkable materials ROLIC AG (CH) 2012-12-11 US disclosed
US-8173749-B2 Photocrosslinkable materials ROLIC AG (CH) 2012-05-08 US disclosed
US-20120076952-A1 PHOTOCROSSLINKABLE MATERIALS ROLIC AG (CH) 2012-03-29 US disclosed
US-20080293888-A1 Photocrosslinkable Materials ROLIC AG (CH) 2008-11-27 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 (2 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-20080293888-A1 Photocrosslinkable Materials DDC, PARG, ALAD MAPT 295/4885KDM4E 1831/4885KMT2A 666/4885
US-20120076952-A1 PHOTOCROSSLINKABLE MATERIALS DDC, PARG, ALAD MAPT 295/4885KDM4E 1831/4885KMT2A 666/4885

“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.