SCHEMBL20738464

SCHEMBL20738464

C[C@H](CO)c1cccc(O)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB1 P08588 2/20 0.53
ADRA1A P35348 2/20 0.53
MIF P14174 1/20 0.53
HTR2A P28223 1/20 0.53
HTR2B P41595 1/20 0.53
HIF1A Q16665 4/20 0.50
SLC6A3 Q01959 2/20 0.50
ADRB2 P07550 1/20 0.50
HTR1A P08908 1/20 0.50
ADRA2A P08913 1/20 0.50
ADRB3 P13945 1/20 0.50
TSHR P16473 1/20 0.50
ADRA2B P18089 1/20 0.50
ADRA2C P18825 1/20 0.50
NFKB1 P19838 1/20 0.50
DRD1 P21728 1/20 0.50
HTR7 P34969 1/20 0.50
ADRA1B P35368 1/20 0.50
DRD3 P35462 1/20 0.50
RAB9A P51151 1/20 0.50

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
SCHEMBL9169343 1.00 ADRB1 (0.53) ADRB1ADRA1AMIFHTR2AHTR2B
SCHEMBL5247771 0.87 ABCB11 (0.50) ADRB1ADRA1AMIFHTR2AHTR2B
SCHEMBL17399704 0.83 HDAC4 (0.62) ADRB1ADRA1AMIFHTR2AHTR2B
SCHEMBL97542 0.83 HDAC4 (0.62) ADRB1ADRA1AMIFHTR2AHTR2B
SCHEMBL26061384 0.82 ADRB1 (0.52) ADRB1ADRA1AMIFHTR2AHTR2B
SCHEMBL6152200 0.82 TAAR1 (0.57) ADRB1ADRA1AMIFHTR2AHTR2B
SCHEMBL632781 0.82 TAAR1 (0.57) ADRB1ADRA1AMIFHTR2AHTR2B
SCHEMBL15427747 0.82 ADRB1 (0.52) ADRB1ADRA1AMIFHTR2AHTR2B
SCHEMBL25094316 0.81 HDAC4 (0.47) HIF1ATSHRKDM4EGAAHDAC4
Butane SCHEMBL28745339 0.80 HDAC4 (0.59) ADRB1ADRA1AMIFHTR2AHTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10457669-B2 Benzolactam compounds as protein kinase inhibitors OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2019-10-29 US disclosed
US-20190047990-A1 BENZOLACTAM COMPOUNDS AS PROTEIN KINASE INHIBITORS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2019-02-14 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 (2 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-20190047990-A1 BENZOLACTAM COMPOUNDS AS PROTEIN KINASE INHIBITORS MAPK1, ALK, MAP3K1 ADRB1 817/4885ADRA1A 919/4885MIF 4013/4885
US-10457669-B2 Benzolactam compounds as protein kinase inhibitors MAPK1, ALK, MAP3K1 ADRB1 817/4885ADRA1A 919/4885MIF 4013/4885

“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.