SCHEMBL19008166

SCHEMBL19008166

CC(C)c1cccc(CNC2CN(C)C2)c1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 9/20 0.47
▸ CTSD P07339 8/20 0.47
▸ CARM1 Q86X55 7/20 0.47
▸ PRMT6 Q96LA8 7/20 0.47
▸ MAP4K4 O95819 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.40
▸ BCHE P06276 1/20 0.40

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
SCHEMBL5022826 0.84 ALDH1A1 (0.51) BACE1CTSDCARM1PRMT6ALDH1A1
SCHEMBL18626538 0.82 ALDH1A1 (0.60) BACE1CTSDALDH1A1
SCHEMBL19008153 0.82 ALDH1A1 (0.56) BACE1CTSDALDH1A1
SCHEMBL19008152 0.81 BACE1 (0.52) BACE1CTSDMAP4K4ALDH1A1BCHE
SCHEMBL19016226 0.80 CARM1 (0.50) BACE1CARM1PRMT6MAP4K4ALDH1A1
SCHEMBL15587607 0.80 BCHE (0.59) BACE1CARM1PRMT6MAP4K4ALDH1A1
SCHEMBL19008147 0.79 ALDH1A1 (0.47) BACE1CTSDCARM1PRMT6ALDH1A1
SCHEMBL19008156 0.78 ALDH1A1 (0.46) BACE1CTSDCARM1PRMT6ALDH1A1
SCHEMBL19008149 0.78 ALDH1A1 (0.46) BACE1CTSDMAP4K4ALDH1A1
SCHEMBL19008155 0.78 MAP4K4 (0.46) CARM1PRMT6MAP4K4ALDH1A1

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-9855269-B2 Aminoquinazoline and pyridopyrimidine derivatives GENENTECH, INC. (US) 2018-01-02 — — US disclosed
US-20170173026-A1 AMINOQUINAZOLINE AND PYRIDOPYRIMIDINE DERIVATIVES GENENTECH, INC. (US) 2017-06-22 — — 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-20170173026-A1 AMINOQUINAZOLINE AND PYRIDOPYRIMIDINE DERIVATIVES FLT4, FLT1, KDR BACE1 3929/4885CTSD 3865/4885CARM1 2613/4885

“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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