SCHEMBL2686112

SCHEMBL2686112

COc1ccc(C(CC(N)CO)(c2ccccc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 12/20 0.64
KCNH2 Q12809 1/20 0.54
LMNA P02545 1/20 0.41
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.39
LTA4H P09960 1/20 0.39
CA4 P22748 1/20 0.38
SLC6A2 P23975 1/20 0.38
SLC6A4 P31645 1/20 0.38

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
SCHEMBL7147740 0.81 KIF11 (0.61) KIF11KCNH2LMNAHTTSMN1; SMN2
SCHEMBL26068376 0.79 KIF11 (0.61) KIF11KCNH2
SCHEMBL2897015 0.79 KIF11 (0.61) KIF11KCNH2
SCHEMBL1263156 0.79 KIF11 (0.61) KIF11KCNH2
SCHEMBL7912698 0.79 KIF11 (0.45) KIF11KCNH2LMNAHTTSMN1; SMN2
SCHEMBL19652449 0.79 KIF11 (0.58) KIF11KCNH2LMNAHTTSMN1; SMN2
SCHEMBL5838167 0.79 KIF11 (0.60) KIF11KCNH2LMNAHTTSMN1; SMN2
SCHEMBL8592606 0.79 KIF11 (0.60) KIF11KCNH2LMNAHTTSMN1; SMN2
SCHEMBL14432808 0.78 KIF11 (1.00) KIF11
SCHEMBL14537457 0.78 KIF11 (1.00) KIF11

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-9435796-B2 Cyanine dyes BIOSEARCH TECHNOLOGIES, INC. (US) 2016-09-06 US disclosed
US-8436153-B2 Cyanine dyes BIOSEARCH TECHNOLOGIES, INC. (US) 2013-05-07 US disclosed
US-20120115133-A1 CYANINE DYES BIOSEARCH TECHNOLOGIES INC. (US) 2012-05-10 US disclosed
US-20100136567-A1 CYANINE DYES BIOSEARCH TECHNOLOGIES, INC. (US) 2010-06-03 US disclosed
US-7705150-B2 Cyanine dyes BIOSEARCH TECHNOLOGIES, INC. (US) 2010-04-27 US disclosed
US-20050214833-A1 Cyanine dyes BIOSEARCH TECHNOLOGIES, INC. (US) 2005-09-29 US disclosed
US-6187913-B1 Covalently crosslinked oligonucleotides, preparation method and synthon which is of use in the method GENSET (FR) 2001-02-13 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-20100136567-A1 CYANINE DYES ACR, IK, TYR KIF11 827/4885KCNH2 1766/4885LMNA 2300/4885
US-20050214833-A1 Cyanine dyes ACR, IK, TYR KIF11 827/4885KCNH2 1766/4885LMNA 2300/4885

“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.