SCHEMBL14927407

SCHEMBL14927407

CCC1(COCCc2ccccc2)COC1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
TSHR P16473 1/20 0.37
CTSK P43235 1/20 0.35
MAOA P21397 3/20 0.35
MAOB P27338 3/20 0.35
CHRM2 P08172 1/20 0.34
CHRM1 P11229 1/20 0.34
CHRM3 P20309 1/20 0.34
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
POLB P06746 1/20 0.33
HSD17B10 Q99714 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
SCHEMBL16535500 0.92 TSHR (0.36) MEN1KMT2ATSHRCTSKPOLB
SCHEMBL14256285 0.88 TDP1 (0.48) MEN1KMT2ATDP1L3MBTL1
SCHEMBL21183917 0.86 FAAH (0.33) MEN1KMT2ATSHRCTSK
SCHEMBL14256235 0.85 POLB (0.37) MEN1KMT2ATSHRCTSKTDP1
SCHEMBL213520 0.84 TSHR (0.45) MEN1KMT2ATSHRCTSKTDP1
SCHEMBL14927406 0.83 TSHR (0.36) MEN1KMT2ATSHRCTSKPOLB
SCHEMBL14927412 0.81 KDM4E (0.36) MEN1KMT2ATSHRL3MBTL1
SCHEMBL365206 0.81 GP6 (0.36) MEN1KMT2ATSHRCTSKTDP1
SCHEMBL15725999 0.81 MEN1 (0.36) MEN1KMT2AMAOAMAOBCHRM2
SCHEMBL28001128 0.80 TSHR (0.41) MEN1KMT2ATSHRCTSKTDP1

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-9382253-B2 Metal complexes MERCK PATENT GMBH (DE) 2016-07-05 US disclosed
US-20130112921-A1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2013-05-09 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-20130112921-A1 METAL COMPLEXES MCOLN2, MCOLN1, NCLN MEN1 145/4885KMT2A 1833/4885TSHR 4843/4885

“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.