SCHEMBL2878003

SCHEMBL2878003

CC1(C)Oc2cc(N)c(N)cc2C(NCCc2ccc(F)cc2)C1O

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 4/20 0.40
KCNA5 P22460 7/20 0.39
TAAR1 Q96RJ0 1/20 0.35
KCNE1 P15382 3/20 0.35
KCNQ1 P51787 3/20 0.35
ABCC9 O60706 1/20 0.34

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
SCHEMBL2878005 1.00 ABCB1 (0.40) ABCB1KCNA5TAAR1KCNE1KCNQ1
SCHEMBL2007814 0.88 ABCB1 (0.51) ABCB1KCNA5ABCC9
SCHEMBL2889446 0.88 ABCB1 (0.51) ABCB1KCNA5ABCC9
SCHEMBL2888730 0.84 NPC1 (0.42) ABCB1KCNA5TAAR1KCNE1KCNQ1
SCHEMBL2888729 0.84 NPC1 (0.42) ABCB1KCNA5TAAR1KCNE1KCNQ1
Hydrochloric Acid SCHEMBL2883776 0.83 NPC1 (0.41) ABCB1KCNA5TAAR1KCNE1KCNQ1
Hydrochloric Acid SCHEMBL2883774 0.83 NPC1 (0.41) ABCB1KCNA5TAAR1KCNE1KCNQ1
SCHEMBL2888796 0.82 ABCB1 (0.41) ABCB1KCNA5TAAR1
SCHEMBL2875861 0.82 ABCB1 (0.41) ABCB1KCNA5TAAR1
SCHEMBL6276071 0.82 KCNA5 (0.48) ABCB1KCNA5ABCC9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1732929-B1 TRICYCLIC BENZOPYRAN COMPOUND AS ANTI-ARRHYTHMIC AGENTS NISSAN CHEMICAL IND LTD (JP) 2010-10-20 EP disclosed
US-7652008-B2 2,2,7,9-tetramethyl-4-[(2-phenylethyl)amino]-3,4-dihydro-2H-pyrano[2,3-g]quinolin-3-ol; 3-hydroxy-2,2,9-trimethyl-4-[(2-phenylethyl)amino]-3,4-dihydro-2H-pyrano[2,3-g]quinolin-7-carbonitrile; have the prolongation effect on refractory period NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2010-01-26 US disclosed
US-20080004262-A1 Tricyclic Benzopyrane Compound as Anti-Arrhythmic Agents NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2008-01-03 US disclosed
EP-1732929-A1 TRICYCLIC BENZOPYRAN COMPOUND AS ANTI-ARRHYTHMIC AGENTS Nissan Chemical Industries, Ltd. (JP) 2006-12-20 EP disclosed
WO-2005090357-A1 TRICYCLIC BENZOPYRAN COMPOUND AS ANTI-ARRHYTHMIC AGENTS NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2005-09-29 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 (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-20080004262-A1 Tricyclic Benzopyrane Compound as Anti-Arrhythmic Agents CBR1, CBR3, SCN8A ABCB1 580/4885KCNA5 67/4885TAAR1 1212/4885

“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.