SCHEMBL19944855

SCHEMBL19944855

COc1cc(C(=O)NCC(O)(c2cc3c(c(-c4ccc(F)cc4)n2)OCC3(C)N)C(F)(F)F)ccc1OC1CC1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 3/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
PDE4D Q08499 4/20 0.36
PDE4A P27815 3/20 0.35
PDE4B Q07343 3/20 0.35
PDE4C Q08493 3/20 0.35
SLC5A7 Q9GZV3 2/20 0.35
TDP1 Q9NUW8 1/20 0.35
RAB9A P51151 1/20 0.35
GRM7 Q14831 1/20 0.35
ALDH1A1 P00352 1/20 0.34

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
SCHEMBL19945549 1.00 EPHX2 (0.36) EPHX2MEN1KMT2APDE4DPDE4A
SCHEMBL19944890 1.00 EPHX2 (0.36) EPHX2MEN1KMT2APDE4DPDE4A
SCHEMBL16549080 1.00 EPHX2 (0.36) EPHX2MEN1KMT2APDE4DPDE4A
SCHEMBL18033284 0.97 EPHX2 (0.39) EPHX2MEN1KMT2APDE4DPDE4A
SCHEMBL18032906 0.97 SLC5A7 (0.35) EPHX2MEN1KMT2APDE4DPDE4A
SCHEMBL16549028 0.94 ALDH1A1 (0.33) EPHX2MEN1KMT2APDE4DGRM7
SCHEMBL21180191 0.93 GABRA5 (0.34) EPHX2PDE4DPDE4APDE4BPDE4C
SCHEMBL18033194 0.93 GABRA5 (0.34) EPHX2PDE4DPDE4APDE4BPDE4C
SCHEMBL18033611 0.93 GABRA5 (0.34) EPHX2PDE4DPDE4APDE4BPDE4C
SCHEMBL18033019 0.93 GABRA5 (0.34) EPHX2PDE4DPDE4APDE4BPDE4C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10358453-B2 Antiviral compounds ALIOS BIOPHARMA, INC. (US) 2019-07-23 US disclosed
US-20180065932-A1 ANTIVIRAL COMPOUNDS ALIOS BIOPHARMA, INC. 2018-03-08 US disclosed
WO-2016138158-A1 ANTIVIRAL COMPOUNDS ALIOS BIOPHARMA, INC. (US) 2016-09-01 WO disclosed
US-20160244460-A1 ANTIVIRAL COMPOUNDS Janssen Pharmaceuticals, Inc. 2016-08-25 US disclosed
US-20150065504-A1 ANTIVIRAL COMPOUNDS ALIOS BIOPHARMA, INC. 2015-03-05 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 (4 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-20180065932-A1 ANTIVIRAL COMPOUNDS MAVS, SARS1, ZC3HAV1 EPHX2 4523/4885MEN1 4812/4885KMT2A 4241/4885
US-10358453-B2 Antiviral compounds MAVS, SARS1, ZC3HAV1 EPHX2 4523/4885MEN1 4812/4885KMT2A 4241/4885
US-20160244460-A1 ANTIVIRAL COMPOUNDS MAVS, SARS1, ZC3HAV1 EPHX2 4523/4885MEN1 4812/4885KMT2A 4241/4885
US-20150065504-A1 ANTIVIRAL COMPOUNDS MAVS, SARS1, ZC3HAV1 EPHX2 4523/4885MEN1 4812/4885KMT2A 4241/4885

“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.