SCHEMBL17362391

SCHEMBL17362391

CC(C)(C)n1ccc2cc(-c3cccc(-c4ccccc4)c3F)cnc21

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ GRIN2B Q13224 13/20 0.35
▸ GRIN1 Q05586 12/20 0.35
▸ MAPT P10636 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ GLO1 Q04760 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ APP P05067 1/20 0.33
▸ ALOX5AP P20292 1/20 0.33
▸ FEN1 P39748 1/20 0.33

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
SCHEMBL17362187 0.83 APP (0.47) GRIN2BGRIN1GLO1APP
SCHEMBL17362346 0.82 USP1 (0.33) MAPTHSD17B10LMNAALOX5APFEN1
SCHEMBL17362135 0.81 GRIN2B (0.44) GRIN2BGRIN1
SCHEMBL17362387 0.81 ALOX5AP (0.39) GRIN2BMAPTCYP1A2CYP3A4CYP2C9
SCHEMBL17362343 0.80 HCAR1 (0.39) GRIN2BGRIN1CYP1A2CYP3A4CYP2C9
SCHEMBL21167296 0.79 APP (0.36) GLO1APP
SCHEMBL15916486 0.77 GLO1 (0.45) GRIN2BGRIN1GLO1
SCHEMBL17362288 0.75 ALDH1A1 (0.33) HSD17B10CYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL17362242 0.73 ALOX5AP (0.39) MAPTHSD17B10ALOX5APFEN1
SCHEMBL22388539 0.69 CNR2 (0.36) APP

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-9745328-B2 Flap modulators JANSSEN PHARMACEUTICA NV (BE) 2017-08-29 — — US disclosed
US-20150376212-A1 FLAP MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2015-12-31 — — 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-20150376212-A1 FLAP MODULATORS FEN1, PGF, TBXA2R GRIN2B 3381/4885GRIN1 2139/4885MAPT 4864/4885

“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.

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