SCHEMBL12665772

SCHEMBL12665772

CC(C)(C)OC1CCN2CCC1C2

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CHRM1 P11229 4/20 0.43
▸ CHRM2 P08172 5/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ CYP2D6 P10635 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ CHRNA7 P36544 1/20 0.37
▸ CHRM4 P08173 2/20 0.35
▸ CHRM3 P20309 2/20 0.35
▸ CHRM5 P08912 1/20 0.35

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
SCHEMBL12665763 0.88 CHRM1 (0.51) CHRM1CHRM2MEN1CYP2D6KMT2A
SCHEMBL12395656 0.85 CHRM2 (0.50) CHRM1CHRM2MEN1CYP2D6KMT2A
SCHEMBL12674256 0.71 CHRM1 (0.43) CHRM1CHRM2MEN1CYP2D6KMT2A
SCHEMBL12254244 0.67 — —
SCHEMBL15170714 0.67 — —
SCHEMBL173191 0.67 — —
SCHEMBL15444947 0.67 CHRM2 (0.36) CHRM1CHRM2MEN1CYP2D6KMT2A
SCHEMBL16386083 0.67 CHRM2 (0.36) CHRM1CHRM2MEN1CYP2D6KMT2A
SCHEMBL20995896 0.66 — —
SCHEMBL789549 0.66 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150368244-A1 DIAZACARBAZOLES AND METHODS OF USE GENENTECH, INC. (US) 2015-12-24 — — US disclosed
US-9216980-B2 Methods of use of diazacarbazoles for treating cancer GENENTECH, INC. (US) 2015-12-22 — — US disclosed
US-20150087630-A1 METHODS OF USE OF DIAZACARBAZOLES FOR TREATING CANCER GENENTECH, INC. (US) 2015-03-26 — — US disclosed
US-20130261104-A1 METHODS OF USE OF DIAZACARBAZOLES FOR TREATING CANCER GENENTECH, INC. (US) 2013-10-03 — — US disclosed
US-8501765-B2 Diazacarbazoles and methods of use GENENTECH, INC. (US) 2013-08-06 — — US disclosed
US-20110124654-A1 DIAZACARBAZOLES AND METHODS OF USE ARGENTA DISCOVERY 2009 LIMITED (GB) 2011-05-26 — — US disclosed
US-20110118230-A1 DIAZACARBAZOLES AND METHODS OF USE GENENTECH, INC. 2011-05-19 — — 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 (5 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-20110118230-A1 DIAZACARBAZOLES AND METHODS OF USE CHEK1, CHEK2, BUB1B CHRM1 3638/4885CHRM2 4042/4885MEN1 945/4885
US-20110124654-A1 DIAZACARBAZOLES AND METHODS OF USE CHEK1, CHEK2, BUB1B CHRM1 3310/4885CHRM2 3852/4885MEN1 1132/4885
US-20150087630-A1 METHODS OF USE OF DIAZACARBAZOLES FOR TREATING CANCER IDH3B, IDH3A, EGLN3 CHRM1 1154/4885CHRM2 789/4885MEN1 656/4885
US-20150368244-A1 DIAZACARBAZOLES AND METHODS OF USE CHEK1, CHEK2, BUB1B CHRM1 3310/4885CHRM2 3852/4885MEN1 1132/4885
US-20130261104-A1 METHODS OF USE OF DIAZACARBAZOLES FOR TREATING CANCER IDH3B, IDH3A, EGLN3 CHRM1 1154/4885CHRM2 789/4885MEN1 656/4885

“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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