SCHEMBL18636713

SCHEMBL18636713

CNCC1CCN(CCN(C)C)CC1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.49
CARM1 Q86X55 8/20 0.42
PRMT6 Q96LA8 8/20 0.42
PRMT8 Q9NR22 2/20 0.40
PRMT1 Q99873 1/20 0.40
PIM1 P11309 1/20 0.40
GNAI3 P08754 1/20 0.36
GNAO1 P09471 1/20 0.36
GNAI1 P63096 1/20 0.36
HRH3 Q9Y5N1 1/20 0.35
HTR4 Q13639 1/20 0.34
ALOX15 P16050 1/20 0.33
GSK3B P49841 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
SCHEMBL20739933 0.81 PIM1 (0.38) L3MBTL1CARM1PRMT6PIM1GNAI3
SCHEMBL27317530 0.79 CARM1 (0.64) L3MBTL1CARM1PRMT6PRMT8PRMT1
SCHEMBL23945810 0.79 L3MBTL1 (0.57) L3MBTL1CARM1PRMT6PRMT8PRMT1
SCHEMBL13744813 0.79 PIM1 (0.36) PIM1GNAI3GNAO1GNAI1HRH3
SCHEMBL23181937 0.78 GSK3B (0.43) HTR4GSK3B
SCHEMBL22851678 0.77 PIM1 (0.36) L3MBTL1CARM1PRMT6PIM1GNAI3
SCHEMBL22544374 0.77 L3MBTL1 (0.51) L3MBTL1CARM1PRMT6PRMT8PRMT1
SCHEMBL24172131 0.77 PIM1 (0.36) CARM1PRMT6PRMT8PRMT1PIM1
SCHEMBL2250676 0.77 CARM1 (0.38) CARM1PRMT6PRMT8PRMT1PIM1
SCHEMBL14174933 0.76 GNAO1 (0.42) PIM1GNAI3GNAO1GNAI1HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210393647-A9 ACETAMIDE THIENOTRIAZOLODIAZEPINES AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2021-12-23 US disclosed
US-20210093644-A1 ACETAMIDE THIENOTRIAZOLODIAZEPINES AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2021-04-01 US disclosed
US-10881668-B2 Acetamide thienotriazolodiazepines and uses thereof DANA-FARBER CANCER INSTITUTE, INC. (US) 2021-01-05 US disclosed
WO-2019165229-A1 SMALL MOLECULES FOR INDUCING SELECTIVE PROTEIN DEGRADATION AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2019-08-29 WO disclosed
US-20190046541-A1 ACETAMIDE THIENOTRIAZOLODIAZEPINES AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. 2019-02-14 US disclosed
WO-2017044792-A1 ACETAMIDE THIENOTRIAZOLDIAZEPINES AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2017-03-16 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 (4 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-20190046541-A1 ACETAMIDE THIENOTRIAZOLODIAZEPINES AND USES THEREOF BRDT, BRD4, BRD3 L3MBTL1 3238/4885CARM1 948/4885PRMT6 1204/4885
US-20210093644-A1 ACETAMIDE THIENOTRIAZOLODIAZEPINES AND USES THEREOF BRDT, BRD4, BRD3 L3MBTL1 3284/4885CARM1 960/4885PRMT6 1275/4885
US-10881668-B2 Acetamide thienotriazolodiazepines and uses thereof BRDT, BRD4, BRD3 L3MBTL1 3238/4885CARM1 948/4885PRMT6 1204/4885
US-20210393647-A9 ACETAMIDE THIENOTRIAZOLODIAZEPINES AND USES THEREOF BRDT, BRD4, BRD3 L3MBTL1 3284/4885CARM1 960/4885PRMT6 1275/4885

“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.