SCHEMBL19075643

SCHEMBL19075643

CC(C)C1CCN(Cc2cc(C(F)(F)F)cc(Cl)c2F)CC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RORC P51449 7/20 0.42
SCN9A Q15858 2/20 0.42
DCUN1D1 Q96GG9 1/20 0.36
PKM P14618 1/20 0.36
PKLR P30613 1/20 0.36
TACR1 P25103 1/20 0.35
SCN1A P35498 1/20 0.35
SCN4A P35499 1/20 0.35
SCN7A Q01118 1/20 0.35
SCN5A Q14524 1/20 0.35
SCN2A Q99250 1/20 0.35
SCN3A Q9NY46 1/20 0.35
SCN8A Q9UQD0 1/20 0.35
DRD2 P14416 1/20 0.35
DRD4 P21917 1/20 0.35
DRD3 P35462 1/20 0.35
GRM2 Q14416 1/20 0.35
ADORA2B P29275 1/20 0.35
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34

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
SCHEMBL20697640 0.86 SCN9A (0.42) RORCSCN9ADCUN1D1PKMPKLR
SCHEMBL18908954 0.86 SCN9A (0.43) RORCSCN9ADCUN1D1PKMPKLR
SCHEMBL19075619 0.84 SLC6A2 (0.47) RORCSCN9ADCUN1D1SCN1ASCN4A
SCHEMBL19084092 0.84 SCN9A (0.42) RORCSCN9ADCUN1D1PKMPKLR
SCHEMBL19075627 0.83 OPRM1 (0.38) RORCDRD2DRD4DRD3KDM4E
SCHEMBL20697685 0.80 ALOX5AP (0.44) DCUN1D1DRD2OPRM1OPRD1OPRL1
SCHEMBL19075617 0.79 SCN9A (0.45) RORCSCN9APKMPKLRKDM4E
SCHEMBL19427314 0.79 SCN9A (0.50) RORCSCN9APKMPKLRADORA2B
SCHEMBL19083688 0.77 SCN9A (0.47) RORCSCN9APKMPKLRADORA2B
SCHEMBL21075596 0.77 KCNH2 (0.42) DCUN1D1TACR1KDM4EALDH1A1

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
US-11149002-B2 Therapeutic compounds and methods of use thereof GENENTECH, INC. (US) 2021-10-19 US disclosed
US-20210078947-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2021-03-18 US disclosed
US-20190031607-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2019-01-31 US disclosed
US-10005724-B2 Therapeutic compounds and methods of use thereof GENENTECH, INC. (US) 2018-06-26 US disclosed
US-10005724-B2 Therapeutic compounds and methods of use thereof GENENTECH, INC. (US) 2018-06-26 US disclosed
US-20170190662-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2017-07-06 US disclosed
US-20170190662-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2017-07-06 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 (5 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-20170190662-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF RDX, C1R, MTX1 RORC 717/4885SCN9A 2337/4885DCUN1D1 3112/4885
US-11149002-B2 Therapeutic compounds and methods of use thereof RDX, C1R, MTX1 RORC 717/4885SCN9A 2337/4885DCUN1D1 3112/4885
US-20190031607-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF RDX, C1R, MTX1 RORC 717/4885SCN9A 2337/4885DCUN1D1 3112/4885
US-10005724-B2 Therapeutic compounds and methods of use thereof RDX, C1R, MTX1 RORC 717/4885SCN9A 2337/4885DCUN1D1 3112/4885
US-20210078947-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF RDX, C1R, MTX1 RORC 717/4885SCN9A 2337/4885DCUN1D1 3112/4885

“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.