SCHEMBL8342199

SCHEMBL8342199

CC1(C)Oc2ccc(C#N)cc2[C@H](N)[C@H]1O

nearest known ligand 0.60

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.60
ABCB1 P08183 10/20 0.58
ABCC9 O60706 4/20 0.57
KCNE1 P15382 3/20 0.56
KCNQ1 P51787 3/20 0.56
CYP1A2 P05177 2/20 0.56
CYP2D6 P10635 2/20 0.56
CYP2C19 P33261 2/20 0.56
MEN1 O00255 1/20 0.56
CYP3A4 P08684 1/20 0.56
KMT2A Q03164 1/20 0.56
KCND3 Q9UK17 1/20 0.56
ABCC8 Q09428 2/20 0.54
KCNJ11 Q14654 2/20 0.54
KCNJ8 Q15842 2/20 0.54
CYP2C9 P11712 1/20 0.54
LMNA P02545 1/20 0.54

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
SCHEMBL481521 1.00 KDM4E (0.60) KDM4EABCB1ABCC9KCNE1KCNQ1
SCHEMBL9260381 1.00 KDM4E (0.60) KDM4EABCB1ABCC9KCNE1KCNQ1
SCHEMBL482186 1.00 KDM4E (0.60) KDM4EABCB1ABCC9KCNE1KCNQ1
SCHEMBL8616133 1.00 KDM4E (0.60) KDM4EABCB1ABCC9KCNE1KCNQ1
SCHEMBL9260385 1.00 KDM4E (0.60) KDM4EABCB1ABCC9KCNE1KCNQ1
SCHEMBL8983412 1.00 KDM4E (0.60) KDM4EABCB1ABCC9KCNE1KCNQ1
Hydrochloric Acid SCHEMBL9851469 0.99 KDM4E (0.58) KDM4EABCB1ABCC9KCNE1KCNQ1
SCHEMBL9315796 0.85 KDM4E (0.47) KDM4EABCB1ABCC9KCNE1KCNQ1
SCHEMBL9395036 0.85 KDM4E (0.44) KDM4EABCB1ABCC9KCNE1KCNQ1
SCHEMBL9394349 0.85 KDM4E (0.44) KDM4EABCB1ABCC9KCNE1KCNQ1

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 76 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5239090-A Certain optically active 3,4-dihydrobenzopyran-4-ols which are intermediates BEECHAM GROUP P.L.C. (GB) 1993-08-24 US claimed
EP-0385584-A1 Method for the preparation of 4-(cyclic-amido)-2H-1-benzopyrans and 4-amino-3-hydroxy-2H-1-benzopyrans BEECHAM GROUP PLC (GB) 1990-09-05 EP claimed
EP-0076075-B1 PHARMACEUTICALLY ACTIVE BENZOPYRAN COMPOUNDS BEECHAM GROUP PLC (GB) 1986-11-20 EP claimed
JP-3014573-A None JP disclosed
US-5908860-A Bicyclic compounds with pharmaceutical activity SMITHKLINE BEECHAM PLC, (GB) 1999-06-01 US disclosed
US-5837702-A HAVING POTASSIUM CHANNEL ACTIVATING ACTIVITY USEFUL AS CARDIOVASCULAR AGENTS AND TREATMENT OF ISCHEMIA BRISTOL-MYERS SQUIBB CO. (US) 1998-11-17 US disclosed
US-5563170-A Substituted cyanoimino benzopyranes E. R. SQUIBB & SONS, INC. (US) 1996-10-08 US disclosed
EP-0401010-B1 Pyranyl cyanoguanidine derivatives SQUIBB & SONS INC (US) 1996-08-21 EP disclosed
EP-0501797-B1 Pyranyl cyanoguanidine derivatives SQUIBB & SONS INC (US) 1996-06-05 EP disclosed
US-5466817-A Benzopyran derivatives and heterocyclic analogs thereof as antiischemic agents E.R. SQUIBB & SONS, INC. (US) 1995-11-14 US disclosed
EP-0673373-A1 BICYCLIC COMPOUNDS WITH PHARMACEUTICAL ACTIVITY SMITHKLINE BEECHAM PLC (GB) 1995-09-27 EP disclosed
US-4575511-A Anti-hypertensive chromanol derivatives BEECHAM GROUP P.L.C. (GB) 1986-03-11 US disclosed
US-4571406-A Anti-hypertensive chromans and chromenes BEECHAM GROUP P.L.C. (GB) 1986-02-18 US disclosed
US-4510152-A Antihypertensive chromenes and chromans BEECHAM GROUP P.L.C. (GB) 1985-04-09 US disclosed
EP-0126367-A1 Chroman and chromene derivatives BEECHAM GROUP PLC (GB) 1984-11-28 EP disclosed
EP-0126350-A1 Novel compounds BEECHAM GROUP PLC (GB) 1984-11-28 EP disclosed
EP-0126311-A2 Benzopyran derivatives. BEECHAM GROUP PLC (GB) 1984-11-28 EP disclosed
EP-0120427-A1 3,4-Dihydro-thiaoxo-1-pyrrolidinyl-or piperidinyl-ZH-benzo[b]pyrons BEECHAM GROUP PLC (GB) 1984-10-03 EP disclosed
US-4446113-A HYPOTENSIVE AGENTS BEECHAM GROUP P.L.C. (GB) 1984-05-01 US disclosed
EP-0093535-A1 Novel chromenes and chromans BEECHAM GROUP PLC (GB) 1983-11-09 EP disclosed