SCHEMBL16748041

SCHEMBL16748041

CNCC1CCN(CC(F)F)CC1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.43
CARM1 Q86X55 5/20 0.37
PRMT6 Q96LA8 5/20 0.37
KCNH2 Q12809 3/20 0.36
CACNA1I Q9P0X4 3/20 0.36
PRMT1 Q99873 1/20 0.33
PRMT8 Q9NR22 1/20 0.33
CXCR4 P61073 1/20 0.33
GNAI3 P08754 1/20 0.30
GNAO1 P09471 1/20 0.30
GNAI1 P63096 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
SCHEMBL23568463 0.82 L3MBTL1 (0.44) L3MBTL1CARM1PRMT6KCNH2CACNA1I
SCHEMBL23588513 0.81 SAT1 (0.39) CARM1PRMT6KCNH2CACNA1ICXCR4
SCHEMBL19476277 0.81 KCNH2 (0.35) CARM1PRMT6KCNH2CACNA1I
SCHEMBL17010888 0.80 CACNA1I (0.40) KCNH2CACNA1I
SCHEMBL8427954 0.78 SLC18A3 (0.34) KCNH2CACNA1I
SCHEMBL12605183 0.75 L3MBTL1 (0.47) L3MBTL1CARM1PRMT6PRMT1PRMT8
SCHEMBL8246654 0.74 SLC6A3 (0.33)
SCHEMBL14393411 0.74 HRH3 (0.37) KCNH2CACNA1IGNAO1
SCHEMBL19010251 0.74 EPHX1 (0.40) CARM1PRMT6KCNH2CACNA1I
SCHEMBL16748042 0.74 L3MBTL1 (0.46) L3MBTL1CARM1PRMT6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170355712-A1 AMINE-SUBSTITUTED ARYL OR HETEROARYL COMPOUNDS Epizyme, Inc. 2017-12-14 US disclosed
US-9108953-B2 Quinoline derivatives as bromodomain inhibitors GILEAD SCIENCES, INC. (US) 2015-08-18 US disclosed
US-20150148344-A1 QUINOLINE DERIVATIVES AS BROMODOMAIN INHIBITORS GILEAD SCIENCES, INC. 2015-05-28 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-20170355712-A1 AMINE-SUBSTITUTED ARYL OR HETEROARYL COMPOUNDS SHMT1, BHMT, BHMT2 L3MBTL1 969/4885CARM1 24/4885PRMT6 36/4885
US-20150148344-A1 QUINOLINE DERIVATIVES AS BROMODOMAIN INHIBITORS BRD4, BRD7, BRD3 L3MBTL1 1104/4885CARM1 366/4885PRMT6 340/4885

“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.