SCHEMBL752332

SCHEMBL752332

COC(=O)c1cc(F)ccc1Cc1ccc(C(=O)C2=C(OC)C(=O)N(C(C)C)C2)o1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.36
POLB P06746 3/20 0.34
P2RX3 P56373 1/20 0.33
USP2 O75604 2/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
KDM4E B2RXH2 4/20 0.33
ALDH1A1 P00352 3/20 0.33
LMNA P02545 1/20 0.33
RAB9A P51151 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
NPSR1 Q6W5P4 2/20 0.33
PLA2G2A P14555 1/20 0.32
CYP2C19 P33261 2/20 0.31
MAPT P10636 2/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
MAOA P21397 1/20 0.31

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
SCHEMBL756687 0.92 ALDH1A1 (0.33) HTTPOLBALDH1A1MAPTSMN1; SMN2
SCHEMBL753699 0.92 ALDH1A1 (0.33) HTTPOLBALDH1A1LMNA
SCHEMBL753182 0.90 HTT (0.37) HTTPOLBP2RX3USP2TSHR
SCHEMBL755075 0.87 ALDH1A1 (0.33) HTTPOLBALDH1A1NPSR1
SCHEMBL754297 0.85 ALDH1A1 (0.40) HTTPOLBUSP2TSHRMAPK1
SCHEMBL754197 0.84 POLB (0.32) POLBALDH1A1
SCHEMBL756515 0.82 CYP2C9 (0.36) HTTPOLBUSP2TSHRKDM4E
SCHEMBL751997 0.80 ALDH1A1 (0.33) POLBALDH1A1
SCHEMBL752749 0.80 KCNH2 (0.34) HTTPOLBUSP2ALDH1A1ALOX15
SCHEMBL16921574 0.77 ALDH1A1 (0.34) POLBALDH1A1LMNA

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-9572813-B2 Antiviral agent SHIONOGI & CO., LTD. (JP) 2017-02-21 US disclosed
US-20150202208-A1 ANTIVIRAL AGENT SHIONOGI & CO., LTD. (JP) 2015-07-23 US disclosed
EP-1422218-B1 ANTIVIRAL AGENT SHIONOGI & CO (JP) 2012-03-21 EP 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-20150202208-A1 ANTIVIRAL AGENT ZC3HAV1, ZC3HAV1L, CCNI HTT 4541/4885POLB 107/4885P2RX3 3021/4885

“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.