SCHEMBL20006884

SCHEMBL20006884

OC1CC(CCc2cc(F)ccc2OCc2ccccc2)O1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 6/20 0.45
SLC6A4 P31645 6/20 0.45
SLC6A3 Q01959 6/20 0.45
HTR1A P08908 1/20 0.42
DRD2 P14416 1/20 0.42
KDM1A O60341 3/20 0.40
LMNA P02545 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MRGPRX4 Q96LA9 1/20 0.40
FFAR1 O14842 1/20 0.40
FFAR4 Q5NUL3 1/20 0.40
PTGDR2 Q9Y5Y4 1/20 0.39
ABCB1 P08183 1/20 0.39
ABCG2 Q9UNQ0 1/20 0.39

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
SCHEMBL23940700 1.00 SLC6A2 (0.45) SLC6A2SLC6A4SLC6A3HTR1ADRD2
SCHEMBL24263360 1.00 SLC6A2 (0.45) SLC6A2SLC6A4SLC6A3HTR1ADRD2
SCHEMBL20179479 1.00 SLC6A2 (0.45) SLC6A2SLC6A4SLC6A3HTR1ADRD2
SCHEMBL24263357 0.86 SLC6A2 (0.48) SLC6A2SLC6A4SLC6A3HTR1ADRD2
SCHEMBL19988032 0.80 HTR1A (0.43) SLC6A2SLC6A4SLC6A3HTR1ADRD2
SCHEMBL19988048 0.80 HTR1A (0.43) SLC6A2SLC6A4SLC6A3HTR1ADRD2
SCHEMBL19988037 0.80 HTR1A (0.43) SLC6A2SLC6A4SLC6A3HTR1ADRD2
SCHEMBL20179475 0.80 HTR1A (0.43) SLC6A2SLC6A4SLC6A3HTR1ADRD2
SCHEMBL19988040 0.80 HTR1A (0.43) SLC6A2SLC6A4SLC6A3HTR1ADRD2
SCHEMBL20179436 0.80 HTR1A (0.43) SLC6A2SLC6A4SLC6A3HTR1ADRD2

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-20220056003-A1 NEBIVOLOL SYNTHESIS METHOD AND INTERMEDIATE COMPOUND THEREOF ZHEJIANG AUSUN PHARMACEUTICAL CO., LTD. (CN) 2022-02-24 US disclosed
EP-3299364-B1 NEBIVOLOL SYNTHESIS METHOD AND INTERMEDIATE COMPOUND THEREOF ZHEJIANG AUSUN PHARMACEUTICAL CO LTD (CN) 2021-10-20 EP disclosed
EP-3299364-A1 NEBIVOLOL SYNTHESIS METHOD AND INTERMEDIATE COMPOUND THEREOF Zhejiang Ausun Pharmaceutical Co., Ltd. (CN) 2018-03-28 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-20220056003-A1 NEBIVOLOL SYNTHESIS METHOD AND INTERMEDIATE COMPOUND THEREOF CYP4A11, CYP11B2, CYP11B1 SLC6A2 313/4885SLC6A4 481/4885SLC6A3 872/4885

“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.