SCHEMBL7797206

SCHEMBL7797206

CC1(C)Oc2ccccc2[C@H](N)[C@H]1O

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KCNE1 P15382 4/20 0.49
KCNQ1 P51787 4/20 0.49
ABCB1 P08183 4/20 0.41
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
ABCC9 O60706 3/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
IDO1 P14902 1/20 0.35
ATM Q13315 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
SCHEMBL9354152 1.00 KCNE1 (0.49) KCNE1KCNQ1ABCB1MAOAMAOB
SCHEMBL9354158 1.00 KCNE1 (0.49) KCNE1KCNQ1ABCB1MAOAMAOB
SCHEMBL29653960 1.00 KCNE1 (0.49) KCNE1KCNQ1ABCB1MAOAMAOB
SCHEMBL29653950 1.00 KCNE1 (0.49) KCNE1KCNQ1ABCB1MAOAMAOB
SCHEMBL29172252 1.00 KCNE1 (0.49) KCNE1KCNQ1ABCB1MAOAMAOB
Hydrochloric Acid SCHEMBL11610828 0.98 KCNE1 (0.48) KCNE1KCNQ1ABCB1MAOAMAOB
Hydrochloric Acid SCHEMBL11610839 0.98 KCNE1 (0.48) KCNE1KCNQ1ABCB1MAOAMAOB
Hydrochloric Acid SCHEMBL11610843 0.98 KCNE1 (0.48) KCNE1KCNQ1ABCB1MAOAMAOB
SCHEMBL21408674 0.81 KCNE1 (0.51) KCNE1KCNQ1ABCB1MAOAMAOB
SCHEMBL3409162 0.80 KCNE1 (0.38) KCNE1KCNQ1ABCB1MAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20010027248-A1 Novel receptor SMITHKLINE BEECHAM P.L.C. 2001-10-04 US disclosed
US-6245893-B1 ANTICONVULSANTS, USE IN TREATMENT OR PREVENTION OF NERVOUS SYSTEM DISORDERS SMITHKLINE BEECHAM P.L.C. (GB) 2001-06-12 US disclosed
US-5985334-A Screening methods to identify anti-convulsant compounds SMITHKLINE BEECHAM P.L.C. (GB) 1999-11-16 US disclosed
US-5908860-A Bicyclic compounds with pharmaceutical activity SMITHKLINE BEECHAM PLC, (GB) 1999-06-01 US disclosed
EP-0807122-A1 NOVEL RECEPTOR SMITHKLINE BEECHAM PLC (GB) 1997-11-19 EP disclosed
WO-1996018650-A1 NOVEL RECEPTOR SMITHKLINE BEECHAM P.L.C. (GB) 1996-06-20 WO disclosed
EP-0673373-A1 BICYCLIC COMPOUNDS WITH PHARMACEUTICAL ACTIVITY SMITHKLINE BEECHAM PLC (GB) 1995-09-27 EP disclosed
EP-0126367-B1 Chroman and chromene derivatives BEECHAM GROUP PLC (GB) 1994-10-12 EP disclosed
WO-1994013656-A1 BICYCLIC COMPOUNDS WITH PHARMACEUTICAL ACTIVITY SMITHKLINE BEECHAM PLC (GB) 1994-06-23 WO disclosed
EP-0095316-B1 PHARMACEUTICALLY ACTIVE AMINOBENZOPYRANS BEECHAM GROUP PLC (GB) 1986-12-03 EP disclosed
US-4575511-A Anti-hypertensive chromanol derivatives BEECHAM GROUP P.L.C. (GB) 1986-03-11 US disclosed
US-4568692-A LOWERING BLOOD PRESSURE BEECHAM GROUP P.L.C. 1986-02-04 US disclosed
EP-0126367-A1 Chroman and chromene derivatives BEECHAM GROUP PLC (GB) 1984-11-28 EP disclosed
US-4481214-A 4-Acylaminobenzopyrans useful as anti-hypertensive agents BEECHAM GROUP P.L.C. (GB) 1984-11-06 US disclosed
EP-0095316-A1 Pharmaceutically active aminobenzopyrans BEECHAM GROUP PLC (GB) 1983-11-30 EP disclosed
US-4110347-A ANTIHYPERTENSIVE BEECHAM GROUP LIMITED (GB) 1978-08-29 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-20010027248-A1 Novel receptor ADGRF1, TACR2, GPR4 KCNE1 919/4885KCNQ1 2260/4885ABCB1 3669/4885

“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.