SCHEMBL21024009

SCHEMBL21024009

Cc1ccc2[nH]ncc2c1C(C)(C)Cc1nn(C)c2c(C(C)(C)C)cccc12

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ AXL P30530 1/20 0.34
▸ TRPV1 Q8NER1 5/20 0.33
▸ TRPA1 O75762 1/20 0.32
▸ NOS1 P29475 1/20 0.31
▸ PIK3CA P42336 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
SCHEMBL24089313 0.87 — —
SCHEMBL22924131 0.71 — —
SCHEMBL18408609 0.70 — —
SCHEMBL21938210 0.70 IDO1 (0.38) AXLTRPA1NOS1
SCHEMBL17030759 0.69 IDO1 (0.41) AXLTRPA1NOS1
SCHEMBL25724223 0.68 MAPT (0.33) —
SCHEMBL21734001 0.67 NOS1 (0.32) NOS1
SCHEMBL24285781 0.66 IDO1 (0.34) AXLTRPV1TRPA1NOS1
SCHEMBL20858119 0.66 TRPV1 (0.35) AXLTRPV1TRPA1
SCHEMBL20858102 0.66 HCAR2 (0.32) TRPA1

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-10696655-B2 Therapeutic compounds and uses thereof GENENTECH, INC. (US) 2020-06-30 — — US disclosed
US-20190152949-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2019-05-23 — — 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 (2 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-20190152949-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF EP300, HDAC1, HDAC11 AXL 4482/4885TRPV1 1737/4885TRPA1 2938/4885
US-10696655-B2 Therapeutic compounds and uses thereof EP300, HDAC1, HDAC11 AXL 4482/4885TRPV1 1737/4885TRPA1 2938/4885

“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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