SCHEMBL20904391

SCHEMBL20904391

CC(C)(C)c1c(N)ccc2c1NCCC2

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 1/20 0.34
▸ TRPV1 Q8NER1 1/20 0.33
▸ CA12 O43570 1/20 0.30
▸ CA1 P00915 1/20 0.30
▸ CA2 P00918 1/20 0.30
▸ CA9 Q16790 1/20 0.30

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
SCHEMBL22389361 0.87 GAA (0.33) SRC
SCHEMBL20904541 0.84 SRC (0.31) SRC
SCHEMBL4567536 0.81 SRC (0.35) SRCTRPV1
SCHEMBL20904510 0.81 SRC (0.36) SRCCA12CA1CA2CA9
SCHEMBL20904409 0.78 SRC (0.35) SRC
SCHEMBL22341667 0.77 SRC (0.38) SRCCA12CA1CA2CA9
SCHEMBL20898042 0.75 SRC (0.38) SRCCA12CA1CA2CA9
SCHEMBL25590825 0.75 SRC (0.35) SRCTRPV1
SCHEMBL20898356 0.74 SRC (0.40) SRCCA12CA1CA2CA9
SCHEMBL20898588 0.74 SRC (0.36) SRCCA12CA1CA2CA9

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-20200276102-A1 SPECIFIC 7-AMINO-1,2,3,4-TETRAHYDROQUINOLINES, METHOD, AND COMPOSITION L'OREAL (FR) 2020-09-03 — — US disclosed
WO-2019072697-A1 SPECIFIC 7-AMINO-1,2,3,4-TETRAHYDROQUINOLINES, METHOD, AND COMPOSITION L'OREAL (FR) 2019-04-18 — — WO 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-20200276102-A1 SPECIFIC 7-AMINO-1,2,3,4-TETRAHYDROQUINOLINES, METHOD, AND COMPOSITION KRT18, TUBA1C, TPM4 SRC 2302/4885TRPV1 923/4885CA12 3297/4885

“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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