SCHEMBL20006769

SCHEMBL20006769

C#CCCc1cc(F)ccc1OCc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 2/20 0.49
DRD2 P14416 2/20 0.49
L3MBTL1 Q9Y468 3/20 0.46
LMNA P02545 1/20 0.46
ABCB1 P08183 6/20 0.45
ABCG2 Q9UNQ0 1/20 0.45
TRPV6 Q9H1D0 1/20 0.43
FFAR1 O14842 1/20 0.42
FFAR4 Q5NUL3 1/20 0.42
ALDH1A1 P00352 1/20 0.42
PKM P14618 1/20 0.42
MGLL Q99685 1/20 0.41
BCHE P06276 1/20 0.41
MAPT P10636 1/20 0.41
MAPK1 P28482 1/20 0.41
TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL19988039 0.83 HTR1A (0.46) HTR1ADRD2L3MBTL1LMNAABCB1
SCHEMBL18894534 0.81 HTR1A (0.53) HTR1ADRD2L3MBTL1LMNAABCB1
SCHEMBL28020148 0.81 HTR1A (0.53) HTR1ADRD2L3MBTL1LMNAABCB1
SCHEMBL16797594 0.81 HTR1A (0.53) HTR1ADRD2L3MBTL1LMNAABCB1
SCHEMBL20179434 0.81 HTR1A (0.43) HTR1ADRD2L3MBTL1LMNAABCB1
SCHEMBL20175295 0.81 HTR1A (0.43) HTR1ADRD2L3MBTL1LMNAABCB1
SCHEMBL6216693 0.78 HTR1A (0.51) HTR1ADRD2L3MBTL1LMNAABCB1
SCHEMBL6216285 0.78 ELANE (0.53) HTR1ADRD2L3MBTL1LMNAABCB1
SCHEMBL15583063 0.78 HTR1A (0.51) HTR1ADRD2L3MBTL1LMNAABCB1
SCHEMBL7450663 0.78 HTR1A (0.51) HTR1ADRD2L3MBTL1LMNAABCB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3974419-A2 NEBIVOLOL SYNTHESIS METHOD AND INTERMEDIATE COMPOUND THEREOF Zhejiang Ausun Pharmaceutical Co., Ltd. (CN) 2022-03-30 EP disclosed
US-20220056003-A1 NEBIVOLOL SYNTHESIS METHOD AND INTERMEDIATE COMPOUND THEREOF ZHEJIANG AUSUN PHARMACEUTICAL CO., LTD. (CN) 2022-02-24 US disclosed
US-11142512-B2 Nebivolol synthesis method and intermediate compound thereof ZHEJIANG AUSUN PHARMACEUTICAL CO., LTD. (CN) 2021-10-12 US disclosed
US-20200102282-A1 NEBIVOLOL SYNTHESIS METHOD AND INTERMEDIATE COMPOUND THEREOF ZHEJIANG AUSUN PHARMACEUTICAL CO., LTD. (CN) 2020-04-02 US disclosed
US-20180141926-A1 NEBIVOLOL SYNTHESIS METHOD AND INTERMEDIATE COMPOUND THEREOF ZHEJIANG AUSUN PHARMACEUTICAL CO., LTD. (CN) 2018-05-24 US disclosed
US-20180141926-A1 NEBIVOLOL SYNTHESIS METHOD AND INTERMEDIATE COMPOUND THEREOF ZHEJIANG AUSUN PHARMACEUTICAL CO., LTD. (CN) 2018-05-24 US 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 (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-20200102282-A1 NEBIVOLOL SYNTHESIS METHOD AND INTERMEDIATE COMPOUND THEREOF CYP4A11, CYP11B2, ADRB1 HTR1A 1318/4885DRD2 205/4885L3MBTL1 3400/4885
US-11142512-B2 Nebivolol synthesis method and intermediate compound thereof CYP4A11, CYP11B2, ADRB1 HTR1A 1318/4885DRD2 205/4885L3MBTL1 3400/4885
US-20220056003-A1 NEBIVOLOL SYNTHESIS METHOD AND INTERMEDIATE COMPOUND THEREOF CYP4A11, CYP11B2, CYP11B1 HTR1A 1267/4885DRD2 222/4885L3MBTL1 3660/4885
US-20180141926-A1 NEBIVOLOL SYNTHESIS METHOD AND INTERMEDIATE COMPOUND THEREOF CYP4A11, CYP11B2, ADRB1 HTR1A 1318/4885DRD2 205/4885L3MBTL1 3400/4885

“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.