SCHEMBL19036166

SCHEMBL19036166

Cc1ccc2c(c1)CCC(C(O)CN(P)CC(O)C1CCc3cc(F)ccc3O1)O2

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 2/20 0.61
MLNR O43193 1/20 0.61
ADRB2 P07550 1/20 0.61
ADRB1 P08588 1/20 0.61
ADRA2A P08913 1/20 0.61
ADORA3 P0DMS8 1/20 0.61
CHRM1 P11229 1/20 0.61
DRD2 P14416 1/20 0.61
KCNE1 P15382 1/20 0.61
ADRA2B P18089 1/20 0.61
ADRA2C P18825 1/20 0.61
CNR1 P21554 1/20 0.61
SLC6A2 P23975 1/20 0.61
NPY1R P25929 1/20 0.61
HTR2A P28223 1/20 0.61
HTR2C P28335 1/20 0.61
AVPR2 P30518 1/20 0.61
SLC6A4 P31645 1/20 0.61
ADRA1A P35348 1/20 0.61
OPRM1 P35372 1/20 0.61

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
SCHEMBL13446087 1.00 HTR1A (0.61) HTR1AMLNRADRB2ADRB1ADRA2A
SCHEMBL19036167 1.00 HTR1A (0.61) HTR1AMLNRADRB2ADRB1ADRA2A
SCHEMBL19036168 1.00 HTR1A (0.61) HTR1AMLNRADRB2ADRB1ADRA2A
SCHEMBL8170772 0.93 DRD2 (0.69) HTR1AMLNRADRB2ADRB1ADRA2A
SCHEMBL8511597 0.93 DRD2 (0.69) HTR1AMLNRADRB2ADRB1ADRA2A
SCHEMBL8240610 0.93 DRD2 (0.69) HTR1AMLNRADRB2ADRB1ADRA2A
SCHEMBL8169712 0.93 DRD2 (0.69) HTR1AMLNRADRB2ADRB1ADRA2A
SCHEMBL13376761 0.89 HTR1A (0.61) HTR1AMLNRADRB2ADRB1ADRA2A
SCHEMBL14459961 0.86 DRD2 (0.72) HTR1AMLNRADRB2ADRB1ADRA2A
SCHEMBL13762734 0.86 DRD2 (0.72) HTR1AMLNRADRB2ADRB1ADRA2A

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-9822090-B2 Method for producing nebivolol hydrochloride of high purity CORDEN PHARMA INTERNATIONAL GMBH (DE) 2017-11-21 US disclosed
US-20170183323-A1 A NEW METHOD FOR PRODUCING NEBIVOLOL HYDROCHLORIDE OF HIGH PURITY CORDON PHARMA INTERNATIONAL GmbH (DE) 2017-06-29 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 (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-20170183323-A1 A NEW METHOD FOR PRODUCING NEBIVOLOL HYDROCHLORIDE OF HIGH PURITY ADRB2, ADRB1, ADRA2B HTR1A 318/4885MLNR 1013/4885ADRB2 1/4885

“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.