SCHEMBL20718858

SCHEMBL20718858

CCOC(=O)C(C#N)c1c(F)cc([N+](=O)[O-])cc1F

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.42
SMN1; SMN2 Q16637 4/20 0.41
KMT2A Q03164 3/20 0.41
GAA P10253 2/20 0.41
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 8/20 0.40
KDM4E B2RXH2 4/20 0.40
LMNA P02545 3/20 0.40
GLA P06280 1/20 0.39
MAPT P10636 8/20 0.39
CRHBP P24387 1/20 0.38
CRHR2 Q13324 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
AKR1B1 P15121 1/20 0.36
TDP1 Q9NUW8 2/20 0.36
MAPK1 P28482 1/20 0.36
RAB9A P51151 1/20 0.36

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
SCHEMBL19777750 0.85 NPC1 (0.43) NPC1SMN1; SMN2KMT2AGAAMEN1
SCHEMBL29853528 0.84 MAPT (0.43) SMN1; SMN2KMT2AGAAMEN1ALDH1A1
SCHEMBL20718828 0.84 MAPT (0.43) SMN1; SMN2KMT2AGAAMEN1ALDH1A1
SCHEMBL14744412 0.82 NPC1 (0.47) NPC1SMN1; SMN2KMT2AGAAALDH1A1
SCHEMBL21342460 0.80 KMT2A (0.44) NPC1SMN1; SMN2KMT2AGAAMEN1
SCHEMBL7214463 0.80 NPC1 (0.45) NPC1SMN1; SMN2KMT2AGAAALDH1A1
SCHEMBL29177211 0.77 NPC1 (0.43) NPC1KMT2AALDH1A1KDM4ELMNA
SCHEMBL2815023 0.77 MAPT (0.51) NPC1SMN1; SMN2KMT2AGAAMEN1
SCHEMBL23412686 0.76 KMT2A (0.41) NPC1SMN1; SMN2KMT2AGAAMEN1
SCHEMBL14222278 0.75 MAPT (0.46) NPC1SMN1; SMN2KMT2AGAAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3441389-B1 PYRAZOLE-OXAZOLIDINONE COMPOUND FOR ANTI-HEPATITIS B VIRUS SHANGHAI ZHIMENG BIOPHARMA INC (CN) 2021-09-08 EP disclosed
CN-109311865-B Pyrazole-oxazolidinone compound for resisting hepatitis B virus 上海挚盟医药科技有限公司 2021-08-31 CN disclosed
US-20190152963-A1 PYRAZOLE-OXAZOLIDINONE COMPOUND FOR ANTI-HEPATITIS B VIRUS SHANGHAI ZHIMENG BIOPHARMA, INC. (CN) 2019-05-23 US disclosed
EP-3441389-A1 PYRAZOLE-OXAZOLIDINONE COMPOUND FOR ANTI-HEPATITIS B VIRUS Shanghai Zhimeng Biopharma Co., Ltd (CN) 2019-02-13 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-20190152963-A1 PYRAZOLE-OXAZOLIDINONE COMPOUND FOR ANTI-HEPATITIS B VIRUS HAVCR2, ZC3HAV1, ZC3HAV1L NPC1 2254/4885SMN1; SMN2 4730/4885KMT2A 3747/4885

“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.