SCHEMBL2889007

SCHEMBL2889007

CCN(C)c1ccc2c(c1)OC(C)(C)[C@H](O)[C@H]2NCCc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 3/20 0.44
KCNA5 P22460 11/20 0.43
KCNE1 P15382 4/20 0.36
KCNQ1 P51787 4/20 0.36
OPRM1 P35372 1/20 0.35
OPRL1 P41146 1/20 0.35
IDO1 P14902 1/20 0.35

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
Hydrochloric Acid SCHEMBL5662029 0.99 ABCB1 (0.43) ABCB1KCNA5KCNE1KCNQ1OPRM1
Hydrochloric Acid SCHEMBL2893567 0.99 ABCB1 (0.43) ABCB1KCNA5KCNE1KCNQ1OPRM1
SCHEMBL2899395 0.90 ABCB1 (0.46) ABCB1KCNA5KCNE1KCNQ1OPRM1
SCHEMBL2887624 0.90 ABCB1 (0.46) ABCB1KCNA5KCNE1KCNQ1OPRM1
SCHEMBL2887628 0.90 ABCB1 (0.46) ABCB1KCNA5KCNE1KCNQ1OPRM1
Hydrochloric Acid SCHEMBL2888943 0.89 ABCB1 (0.45) ABCB1KCNA5KCNE1KCNQ1OPRM1
Hydrochloric Acid SCHEMBL2901368 0.89 ABCB1 (0.45) ABCB1KCNA5KCNE1KCNQ1OPRM1
Hydrochloric Acid SCHEMBL2888942 0.89 ABCB1 (0.45) ABCB1KCNA5KCNE1KCNQ1OPRM1
SCHEMBL2891650 0.85 KCNA5 (0.45) ABCB1KCNA5KCNE1KCNQ1IDO1
Hydrochloric Acid SCHEMBL2889246 0.84 KCNA5 (0.45) ABCB1KCNA5KCNE1KCNQ1IDO1

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-20070299130-A1 Benzopyran Compound NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2007-12-27 US claimed
US-7781483-B2 Benzopyran compound NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2010-08-24 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-20070299130-A1 Benzopyran Compound NR0B1, CYP2B6, RYR2 ABCB1 978/4885KCNA5 69/4885KCNE1 166/4885

“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.