SCHEMBL19083688

SCHEMBL19083688

CC1(F)CCN(Cc2cc(C(F)(F)F)cc(Cl)c2F)CC1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 1/20 0.47
CYP2D6 P10635 2/20 0.39
CYP3A4 P08684 2/20 0.39
USP2 O75604 5/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C19 P33261 1/20 0.38
OPRL1 P41146 5/20 0.38
OPRM1 P35372 1/20 0.38
PKM P14618 1/20 0.37
PKLR P30613 1/20 0.37
TSHR P16473 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
ALDH1A1 P00352 2/20 0.35
RORC P51449 1/20 0.34
CYP2C9 P11712 1/20 0.34
FAAH O00519 1/20 0.34
ADORA2B P29275 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
SCHEMBL19427314 0.88 SCN9A (0.50) SCN9ACYP2D6CYP3A4USP2CYP1A2
SCHEMBL21075511 0.87 SCN9A (0.45) SCN9ACYP2D6CYP3A4USP2CYP1A2
SCHEMBL21075641 0.86 CYP2D6 (0.40) SCN9ACYP2D6CYP3A4USP2CYP1A2
SCHEMBL19075617 0.86 SCN9A (0.45) SCN9ACYP2D6CYP3A4USP2CYP1A2
SCHEMBL19430890 0.84 SCN9A (0.47) SCN9ACYP2D6CYP3A4USP2CYP1A2
SCHEMBL19427308 0.84 SCN9A (0.56) SCN9ACYP2D6CYP3A4USP2CYP1A2
SCHEMBL19083881 0.83 FAAH (0.47) OPRL1OPRM1ALDH1A1FAAH
SCHEMBL19083727 0.83 OPRL1 (0.46) SCN9AOPRL1OPRM1ALDH1A1FAAH
SCHEMBL23677169 0.82 SCN9A (0.53) SCN9ACYP2D6CYP3A4USP2CYP1A2
SCHEMBL20910903 0.81 SCN9A (0.51) SCN9ACYP2D6CYP3A4USP2CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3854782-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF Genentech, Inc. (US) 2021-07-28 EP disclosed
EP-3166939-B1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF GENENTECH INC (US) 2019-06-05 EP disclosed
WO-2017172802-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2017-10-05 WO 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 (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-20170190662-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF RDX, C1R, MTX1 SCN9A 2337/4885CYP2D6 189/4885CYP3A4 594/4885

“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.