SCHEMBL16448449

SCHEMBL16448449

CC(C)C1(F)C2CC3CC(C2)CC1C3

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC22A2 O15244 1/20 0.32
SLC47A1 Q96FL8 1/20 0.32
GRIN2D O15399 1/20 0.31
GRIN3B O60391 1/20 0.31
GRIN1 Q05586 1/20 0.31
GRIN2A Q12879 1/20 0.31
GRIN2B Q13224 1/20 0.31
GRIN2C Q14957 1/20 0.31
GRIN3A Q8TCU5 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL19083712 0.69 HSD11B1 (0.32) MAPT
SCHEMBL28616387 0.68 SLC22A2 (0.32) SLC22A2SLC47A1GRIN2DGRIN3BGRIN1
SCHEMBL5969134 0.68 SLC22A2 (0.32) SLC22A2SLC47A1GRIN2DGRIN3BGRIN1
SCHEMBL11458453 0.67 MAPT (0.33) MAPT
SCHEMBL27394017 0.67
SCHEMBL27394336 0.67
SCHEMBL29078860 0.67 SLC22A2 (0.31) SLC22A2SLC47A1GRIN2DGRIN3BGRIN1
SCHEMBL10061917 0.65 SLC22A2 (0.30) SLC22A2SLC47A1
SCHEMBL7594383 0.64
SCHEMBL16448447 0.64 HSD11B1 (0.37) MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240228463-A1 SODIUM CHANNEL INHIBITORS AND METHODS OF DESIGNING SAME GENENTECH, INC. (US) 2024-07-11 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-20170002017-A1 N-SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2017-01-05 US disclosed
US-8952169-B2 N-substituted benzamides and methods of use thereof XENON PHARMACEUTICALS INC. (CA) 2015-02-10 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 (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-20170190662-A1 THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF RDX, C1R, MTX1 SLC22A2 1221/4885SLC47A1 431/4885GRIN2D 2193/4885
US-20170002017-A1 N-SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF BRIX1, RDX, SNRPD2 SLC22A2 1487/4885SLC47A1 2600/4885GRIN2D 1981/4885
US-10005724-B2 Therapeutic compounds and methods of use thereof RDX, C1R, MTX1 SLC22A2 1221/4885SLC47A1 431/4885GRIN2D 2193/4885
US-20240228463-A1 SODIUM CHANNEL INHIBITORS AND METHODS OF DESIGNING SAME CACNA1I, CACNA1B, CACNA1C SLC22A2 261/4885SLC47A1 227/4885GRIN2D 395/4885

“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.