SCHEMBL866835

SCHEMBL866835

COc1cc(/C=C/C(=O)C(O)C(c2cc(N)cc(N)c2)C(O)C(=O)/C=C/c2ccc(OC(=O)c3ccc(OCCCC(F)(F)F)cc3)c(OC)c2)ccc1OC(=O)c1ccc(OCCCC(F)(F)F)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.43
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
POLB P06746 1/20 0.43
LMNA P02545 2/20 0.42
MAPT P10636 2/20 0.42
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
CA12 O43570 1/20 0.41
CA4 P22748 1/20 0.41
CA9 Q16790 1/20 0.41
ALDH1A1 P00352 3/20 0.41
GAA P10253 1/20 0.40
HPGD P15428 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
SYK P43405 1/20 0.39
VCP P55072 1/20 0.39
TNFRSF1A P19438 1/20 0.39
APP P05067 3/20 0.39
FDPS P14324 2/20 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
SCHEMBL866761 0.98 KDM4E (0.43) KDM4EMEN1KMT2APOLBLMNA
SCHEMBL865380 0.94 MEN1 (0.43) KDM4EMEN1KMT2APOLBLMNA
SCHEMBL867435 0.92 KMT2A (0.45) KDM4EMEN1KMT2APOLBLMNA
SCHEMBL867059 0.89 KDM4E (0.42) KDM4EMEN1KMT2APOLBLMNA
SCHEMBL867000 0.89 LMNA (0.41) KDM4EMEN1KMT2APOLBLMNA
SCHEMBL1565208 0.88 KMT2A (0.47) KDM4EMEN1KMT2APOLBLMNA
SCHEMBL866260 0.88 PPARA (0.39) KDM4EMAPTAPPABCG2
SCHEMBL864867 0.88 PPARA (0.39) KDM4EMAPTAPPABCG2
SCHEMBL866708 0.87 LMNA (0.41) KDM4EMEN1KMT2APOLBLMNA
SCHEMBL867153 0.86 LMNA (0.41) KDM4EMEN1KMT2APOLBLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107438653-B Photoalignment composition 罗利克有限公司 2022-01-07 CN disclosed
CN-113652167-A Photoalignment composition 罗利克有限公司 2021-11-16 CN disclosed
US-10557085-B2 Photoalignment composition ROLIC AG (CH) 2020-02-11 US disclosed
US-20180079961-A1 PHOTOALIGNMENT COMPOSITION ROLIC AG (CH) 2018-03-22 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 KDM4E 1831/4885MEN1 676/4885KMT2A 666/4885
US-20120076952-A1 PHOTOCROSSLINKABLE MATERIALS DDC, PARG, ALAD KDM4E 1831/4885MEN1 676/4885KMT2A 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.